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Головнёв, Николай Николаевич.
2-тиобарбитуровая кислота и ее комплексы с металлами: синтез, структура и свойства / Н. Н. Головнёв, М. С. Молокеев ; Сиб. федер. ун-т, Рос. акад. наук, Сиб. отд-ние, Ин-т физики им. Л.В. Киренского. - Красноярск : СФУ, 2014. - 252 с. ; 251 с. - Библиогр.: 163 назв. - 500 экз. - 500 экз. - ISBN 978-5-7638-3080-4 : Б. ц.
Аннотация: Рассмотрены и сопоставлены данные по таутомерии, кислотно-основному равновесию в водном растворе, синтезу и структуре полиморфных кристаллических модификаций, спектроскопическим характеристикам 2-тиобарбитуровой кислоты. Дан обзор современного состояния в области синтеза и исследования строения 2-тиобарбитуратных комплексов s-, p- и d-металлов.

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Держатели документа:
Библиотека Института физики им. Л. В. Киренского СО РАН

Доп.точки доступа:
Молокеев, Максим Сергеевич; Molokeev, M. S.; Golovnev N.N.; Сибирский федеральный университет; Российская академия наук; Сибирское отделение РАНИнститут физики им. Л.В. Киренского Сибирского отделения РАН
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    Two salts and the salt cocrystal of ciprofloxacin with thiobarbituric and barbituric acids: The structure and properties / N. N. Golovnev [et al.] // J. Phys. Org. Chem. - 2018. - Vol. 31, Is. 3. - Ст. e3773, DOI 10.1002/poc.3773. - Cited References: 58. - The study was performed within the public task of the Ministry of Education and Science of the Russian Federation to the Siberian Federal University (4.7666.2017/BP) in 2017 to 2019. The reported study was funded by RFBR according to research projects 16-52-48010 and 17-52-53031. The X-ray data from single crystals were obtained with the use of the analytical equipment from the SB RAS Krasnoyarsk Center of collective use. . - ISSN 0894-3230
   Перевод заглавия: Две соли и соляной кристалл ципрофлоксацина с тиобарбитуровой и барбитуровой кислотами: структура и свойства
Кл.слова (ненормированные):
Barbituric and thiobarbituric acids -- Ciprofloxacin -- Infrared spectroscopy -- Salt cocrystal -- Thermal stability -- X-ray diffraction
Аннотация: Ciprofloxacin (CfH, C17H18FN3O3) crystallizes with 2-thiobarbituric (H2tba) and barbituric acid (H2ba) in the aqueous solution to yield salt CfH2(Htba)·3H2O (1), salt cocrystal CfH2(Hba)(H2ba)·3H2O (2), and salt CfH2(Hba)·H2O (3). The compounds are structurally characterized by the X-ray single-crystal diffraction. The numerous intermolecular hydrogen bonds N–H⋯O and O–H⋯O formed by water molecules, Htba−/Hba− and CfH2+ ions, and H2ba molecules stabilize the crystal structures of 1 to 3. Hydrogen bonds form a 2D plane network in the salts of 1 and 3 and a 3D network in the salt cocrystal of 2. There are different π-π interactions in 1 to 3. The compounds have been characterized by powder X-ray diffraction, thermogravimetry/differential scanning calorimetry, and Fourier transform infrared spectroscopy. The compounds dehydration ends at 130°C to 150°C, and their oxidative decomposition is observed in the range of 250°C to 275°C.

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Держатели документа:
Siberian Federal University Krasnoyarsk Russia
Laboratory of Crystal Physics Kirensky Institute of Physics, Federal Research Center KSC SB RAS Krasnoyarsk Russia
Department of Physics Far Eastern State Transport University Khabarovsk Russia
Laboratory of Optical Materials and Structures Institute of Semiconductor Physics SB RAS Novosibirsk Russia
Laboratory of Semiconductor and Dielectric Materials Novosibirsk State University Novosibirsk Russia

Доп.точки доступа:
Golovnev, N. N.; Molokeev, M. S.; Молокеев, Максим Сергеевич; Lesnikov, M. K.; Atuchin, V. V.
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Polymeric lithium(I) diaquabarbiturate: Crystal structure / N. N. Golovnev [et al.] // Russ. J. Inorg. Chem. - 2017. - Vol. 62, Is. 6. - P. 746-750, DOI 10.1134/S0036023617060092. - Cited References:23. - This work was performed in the Siberian Federal University within the State task of the Ministry of Education and Science of the Russian Federation for the period of 2014-2016 (project no. 3049). . - ISSN 0036-0236. - ISSN 1531-8613

РУБ Chemistry, Inorganic & Nuclear
Рубрики:
IONIC CO-CRYSTALS
   BARBITURIC-ACID
   COMPLEXES
   NA
   LI
Аннотация: The lithium(I) catena-diaquabarbiturate complex [Li(H2O)2(HBA–O,O′)]n (I), where Н2ВА is barbituric acid, has been structurally characterized by X-ray diffraction (CIF file CCDC no. 1447689), and its thermal decomposition and IR spectrum have been studied. Crystals of complex I are monoclinic, a = 6.4306(7) Å, b = 16.720(1) Å, c = 7.1732(8) Å, β = 108.253(4)°, V = 732.5(1) Å3, space group P21/c, and Z = 4. One independent μ2-bridging HBA– ligand is coordinated to two Li(I) ions via the two oxygen atoms of C4(6)=O carbonyl groups. Each Li+ ion is linked with two μ2-HBA– ions and two terminal water molecules at tetrahedron vertices. μ2-HBA– ions link tetrahedra into a chain. The structure is stabilized by multiple hydrogen bonds and π–π-interaction between HBA–. The shift of ν(C=O) vibration bands in the IR spectrum of complex I in comparison with Н2ВА towards lower frequencies agrees with the coordination of HBA– via oxygen atoms. The dehydration of complex I occurs in two stages in the regions of 100–150 and 150–240°C.

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Публикация на русском языке Кристаллическая структура полимерного диаквабарбитурата лития(I) [Текст] / Н. Н. Головнев [и др.] // Журн. неорг. химии : Наука, 2017. - Т. 62 № 6. - С. 761-765

Держатели документа:
Siberian Fed Univ, Svobodnyi Pr 79, Krasnoyarsk 660041, Russia.
Russian Acad Sci, Siberian Branch, Kirenskii Inst Phys, Akademgorodok 50-38, Krasnoyarsk 660036, Russia.
Far Eastern State Transport Univ, Ul Serysheva 47, Khabarovsk 680021, Russia.
Russian Acad Sci, Siberian Branch, Inst Chem & Chem Technol, Akademgorodok 50-24, Krasnoyarsk 660036, Russia.

Доп.точки доступа:
Golovnev, N. N.; Molokeev, M. S.; Молокеев, Максим Сергеевич; Lesnikov, M. K.; Vereshchagin, S. N.; Ministry of Education and Science of the Russian Federation [3049]
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    Thiobarbiturate and barbiturate salts of pefloxacin drug: Growth, structure, thermal stability and IR-spectra / N. N. Golovnev [et al.] // J. Mol. Struct. - 2017. - Vol. 1149. - P. 367-372, DOI 10.1016/j.molstruc.2017.08.011. - Cited References: 41. - The study was carried out within the public task of the Ministry of Education and Science of the Russian Federation to the Siberian Federal University (4.7666.2017/BP) in 2017–2019. The reported study was funded by RFBR according to the research project 16-52-48010 and 17-52-53031. The X-ray data from single crystals were obtained with the use of the analytical equipment of the SB RAS Baikal Collective Use Center and using the analytical equipment of the SB RAS Krasnoyarsk Collective Use Center. . - ISSN 0022-2860
   Перевод заглавия: Тиобарбитуровая и барбитуровая соли пефлоксацина: Синтез, структура, термическая стабильность и ИК-спектры
Кл.слова (ненормированные):
Thiobarbituric acid -- Barbituric acid -- Pefloxacin -- X-ray diffraction -- Infrared spectroscopy -- Salts -- Thermal stability
Аннотация: Three new salts of pefloxacin (PefH) with thiobarbituric (H2tba) and barbituric (H2ba) acids, pefloxacinium 2-thiobarbiturate trihydrate, PefH2(Htba)·3H2O (1), pefloxacinium 2-thiobarbiturate, PefH2(Htba) (2) and bis(pefloxacinium barbiturate) hydrate, (PefH2)2(Hba)2·2.56H2O (3) are synthesized and structurally characterized by the X-ray single-crystal diffraction. The structures of 1–3 contain intramolecular hydrogen bonds C–H⋯F, O–H⋯O. Intermolecular hydrogen bonds N–H⋯O and O–H⋯O form a 2D plane network in 1. In 2 and 3, intermolecular hydrogen bonds N–H⋯O form the infinite chains. In 1–3, the Htba− and Hba− ions are connected with PefH2 + only by one intermolecular hydrogen bond N–H⋯O. In 2 and 3, two Htba− and Hba− ions are connected by two hydrogen bonds N–H⋯O. These pairs form infinite chains. All three structures are stabilized by the π−π interactions of the head-to-tail type between PefH2 + ions. Compounds 2 and 3 are characterized by powder XRD, TG-DSC and FT-IR.

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Держатели документа:
Siberian Federal University, 79 Svobodny Ave.Krasnoyarsk, Russian Federation
Laboratory of Crystal Physics, Kirensky Institute of Physics, Federal Research Center KSC SB RAS, Bld. 38 Akademgorodok 50Krasnoyarsk, Russian Federation
Department of Physics, Far Eastern State Transport University, 47 Seryshev Str.Khabarovsk, Russian Federation
Laboratory of Physical Chemistry, Irkutsk Favorsky Institute of Chemistry, SB RAS, 1 FavorskyIrkutsk, Russian Federation
Laboratory of Optical Materials and Structures, Institute of Semiconductor Physics, SB RASNovosibirsk, Russian Federation
Laboratory of Semiconductor and Dielectric Materials, Novosibirsk State UniversityNovosibirsk, Russian Federation

Доп.точки доступа:
Golovnev, N. N.; Molokeev, M. S.; Молокеев, Максим Сергеевич; Lesnikov, M. K.; Sterkhova, I. V.; Atuchin, V. V.
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Vasiliev, A. D.
Structure of the oxonium compound of pefloxacinium hexachloridostannate(IV) / A. D. Vasiliev, N. N. Golovnev // J. Struct. Chem. - 2018. - Vol. 59, Is. 3. - P. 641-645, DOI 10.1134/S0022476618030198. - Cited References: 13. - The work was performed within the State Contact of the Ministry of Education of the Russian Federation and the Siberian Federal University in 2017-2019 (4.7666.2017/BCh) . - ISSN 0022-4766. - ISSN 1573-8779

РУБ Chemistry, Inorganic & Nuclear + Chemistry, Physical
Рубрики:
ANTIBACTERIAL AGENTS
QUINOLONE
Кл.слова (ненормированные):
pefloxacinium cation -- oxonium cation -- chloride ion -- hexachloridostannate(IV) anion -- ionic compound -- crystal structure
Аннотация: The structure of tris{hexachloridostannate(IV)}-hexachloride-tetrakis(pefloxacinium)-tetraoxonium undecahydrate (CCDC 1551760) 4PefH 3 2+ , 4H3O+, 3SnCl 6 2− , 6Cl−, 11H2O (I), (PefH is pefloxacin) is determined. The I crystals are triclinic: a = 13.5474(10) Å, b = 15.2859(11) Å, c = 15.6586(11) Å, α = 94.467(1)°, β = 105.477(1)°, γ = 111.560(1)°, V = 2849.9(4) Å3, space group Pī, Z = 1. The structure is stabilized by multiple intermolecular hydrogen bonds and π–π-interactions between the PefH32+ ions.

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Публикация на русском языке

Держатели документа:
Siberian Fed Univ, Krasnoyarsk, Russia.
Russian Acad Sci, Kirensky Inst Phys, Siberian Branch, Fed Res Ctr KSC, Krasnoyarsk, Russia.

Доп.точки доступа:
Golovnev, N. N.; Васильев, Александр Дмитриевич; Ministry of Education of the Russian Federation [4.7666.2017/BCh]; Siberian Federal University [4.7666.2017/BCh]
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Golovnev, N. N.
Crystal Structure and Properties of Levofloxacinium 2-Thiobarbiturate Trihydrate / N. N. Golovnev, M. S. Molokeev, M. K. Lesnikov // J. Struct. Chem. - 2018. - Vol. 59, Is. 3. - P. 646-651, DOI 10.1134/S0022476618030204. - Cited References: 20. - The work was performed within the State Task of the Ministry of Education and Science of the Russian Federation to the Siberian Federal University for 2017-2019 (4.7666.2017/BCh). . - ISSN 0022-4766. - ISSN 1573-8779

РУБ Chemistry, Inorganic & Nuclear + Chemistry, Physical
Рубрики:
CIPROFLOXACIN
   MONOHYDRATE
   QUINOLONE
   ACID
Кл.слова (ненормированные):
levofloxacin -- 2-thiobarbituric acid -- salt -- crystal structure -- absolute -- structure -- thermal stability -- IR spectrum
Аннотация: The structure of levofloxacinium 2-thiobarbiturate trihydrate LevoH 2 + Htba–·3H2O (I) (LevoH is levofloxacin, H2tba is 2-thiobarbituric acid) is determined (CIF file CCDC No. 1547466); its thermal decomposition and IR spectrum are studied. The crystals of I are triclinic: a = 8.670(1) Å, b = 9.605(1) Å, c = 15.786(2) Å, α = 89.144(5)°, β = 88.279(5)°, γ = 76.068(5)°, V = 1275.4(3) Å3, space group P1, Z = 2. The unit cell of I contains two LevoH 2 + ions, two Htba– ions, and six H2O molecules. The absolute structure of the crystal and the configuration of the chiral center in a levofloxacin molecule S are determined. Experiments for generating the second optical harmonics gave a positive result. Intermolecular hydrogen bonds (HBs) N–H···O and O–H···O in I form a bilayer system along the ab diagonal with hydrophilic moieties within a layer and hydrophobic moieties directed outward. The structure is stabilized by multiple HBs and the π–π interaction between the Htba–and LevoH 2 + ions and between the LevoH 2 + ions.

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Публикация на русском языке Головнёв Н. Н. Кристаллическая структура и свойства тригидрата 2-тиобарбитурата левофлоксациния [Текст] / Н. Н. Головнёв, М. С. Молокеев, М. К. Лесников // Журн. структ. химии. - 2018. - Т. 59 № 3. - С. 668-673

Держатели документа:
Siberian Fed Univ, Krasnoyarsk, Russia.
Russian Acad Sci, Kirensky Inst Phys, Siberian Branch, Krasnoyarsk, Russia.
Far Eastern State Transport Univ, Khabarovsk, Russia.

Доп.точки доступа:
Molokeev, M. S.; Молокеев, Максим Сергеевич; Lesnikov, M. K.; Ministry of Education and Science of the Russian Federation [4.7666.2017/BCh]
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    Головнев, Николай Николаевич.
    Строение гидратов комплексов металлов с барбитуровыми кислотами / Николай Николаевич Головнев, М. С. Молокеев, M. K. Лесников // Журн. СФУ. Химия. - 2017. - Т. 10, № 3. - С. 401-415 ; J. Sib. Fed. Univ. Chem., DOI 10.17516/1998-2836-0036. - Библиогр.: 20. - Работа выполнена в рамках государственного задания Минобрнауки РФ Сибирскому федеральному университету в 2017-2019 гг. (4.7666.2017/БЧ). . - ISSN 1998-2836. - ISSN 2313-6049
   Перевод заглавия: Structure of hydrates of metal complexes with barbituric acids
Кл.слова (ненормированные):
барбитуровые кислоты -- ионы металлов -- комплексы -- гидраты -- структура -- barbituric acids -- metal ions -- complexes -- hydrates -- structure
Аннотация: Обобщены данные о синтезе и структуре комплексов металлов с барбитуровой (H2ba), тиобарбитуровой (H2tba) и 1,3-диэтил-2-тиобарбитуровой (HDetba) кислотами, в состав которых входит различное количество координированных молекул воды. В зависимости от условий из водного раствора кристаллизуются соединения состава [M(H2O)n−kLm]0∙pH2O (Mm+ – ион металла; L− = Hba−, Htba− и Detba−; k≥0, p≥0). Образование нейтральных комплексов [M(H2O)n−kLm]0∙pH2O, содержащих разное количество координированных молекул воды (n−k), имеет место в случае лигандов L− с потенциально разной дентатностью и/или с мостиковым способом координации. Кристаллизация нескольких гидратов [M(H2O)n−kLm]0∙pH2O также ожидается, если в них молекулы воды могут быть как концевыми, так и мостиковыми лигандами, а центральные ионы, например, щелочноземельных металлов, легко образуют разные координационные полиэдры. Синтез новых гидратов может существенно расширить круг доступных соединений, в том числе и с потенциально полезными функциональными свойствами.
Data on the synthesis and structure of metal complexes with barbituric (H2ba), thiobarbituric (H2tba) and 1,3-diethyl-2-thiobarbituric (HDetba) acids, which include a different number of coordinated water molecules, are summarized. Depending on the conditions, compounds of the composition [M(H2O)n−kLm]0∙pH2O (Mm+ – metal ion; L− = Hba−, Htba− и Detba−; k≥0, p≥0) crystallize from the aqueous solution. The formation of neutral complexes of [M(H2O)n−kLm]0∙pH2O containing different amounts of coordinated water molecules (n-k) occurs in the case of L− ligands with potentially different dentateness and/or bridging coordination. Crystallization of several hydrates [M(H2O)n−kLm]0∙pH2O is also expected if water molecules can be both terminal and bridged ligands in them, and central ions, for example, of alkaline earth metals, easily form different coordination polyhedra. Synthesis of new hydrates can significantly expand the range of available compounds, including potentially useful functional properties.

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Держатели документа:
Сибирский федеральный университет
Институт физики им. Л.В. Киренского, ФИЦ КНЦ СО РАН Россия

Доп.точки доступа:
Молокеев, Максим Сергеевич; Molokeev, M. S.; Лесников, Максим Кириллович; Lesnikov M. K.; Golovnev N. N.

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    Novel 1,3-diethyl-2-thiobarbiturates of 2,2′-bipyridine and 1,10-phenanthroline: Synthesis, crystal structure and thermal stability / N. N. Golovnev [et al.] // J. Mol. Struct. - 2018. - Vol. 1171. - P. 488-494, DOI 10.1016/j.molstruc.2018.06.035. - Cited References: 43. - The study was carried out within the public task of the Ministry of Education and Science of the Russian Federation to the Siberian Federal University (4.7666.2017/BP) in 2017–2019 and RFBR according to research projects 17-52-53031. X-ray data from single crystals were obtained with using the analytical equipment of Baikal Center of collective use of SB RAS and with use the analytical equipment of Krasnoyarsk Center of collective use of SB RAS. . - ISSN 0022-2860
   Перевод заглавия: Новые 1,3-диэтил-2-тиобарбитураты 2,2'-бипиридина и 1,10-фенентролина: синтез, кристаллическая структура и термическая стабильность
Кл.слова (ненормированные):
1,3-Diethyl-2-thiobarbituric acid -- 1,10-Phenanthroline -- 2,2′-bipyridine -- Salt -- Salt co-crystal -- Infrared spectroscopy -- Thermal stability
Аннотация: Co-crystallization of 1,3-diethyl-2-thiobarbituric acid (HDetba) with 2,2′-bipyridine (Bipy) and 1,10-phenanthroline (Phen) results in preparing a salt co-crystal, BipyH(Detba)(HDetba) (1), and the salt, PhenH(Detba)·H2O (2). The compounds are characterized by single–crystal and powder X–ray diffraction and TG-DSC. The nitrogen atoms of BipyH+ adopt a cis conformation and the N–C–C–N torsion angle is −17.3(1)º. There are six intermolecular hydrogen bonds O–H⋯O, N–H⋯O, C–H⋯O and C–H⋯S in (1) which form a 2D plane network. One Detba– ion and one HDetba molecule form a pair by means of O–H⋯O hydrogen bonds. Detba− anions in (2) do not form dimers, they are connected by N–H⋯O, C–H⋯S, and C–H⋯O hydrogen bonds only with PhenH+ cations and water molecules which form a 3D net. Different π−π interactions between the rings are found in (1)−(2).

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Держатели документа:
Siberian Federal University, 79 Svobodny Ave., Krasnoyarsk, Russian Federation
Laboratory of Crystal Physics, Kirensky Institute of Physics, Federal Research Center KSC SB RAS, bld. 38 Akademgorodok 50, Krasnoyarsk, Russian Federation
Department of Physics, Far Eastern State Transport University, 47 Seryshev Str., Khabarovsk, Russian Federation
Favorsky Institute of Chemistry, Siberian Branch, Russian Academy of Sciences, 1 Favorsky, Irkutsk, Russian Federation

Доп.точки доступа:
Golovnev, N. N.; Molokeev, M. S.; Молокеев, Максим Сергеевич; Sterkhova, I. V.; Lesnikov, M. K.
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    Coordination effects in hydrated manganese(II) 1,3-diethyl-2-thiobarbiturates and their thermal stability / N. N. Golovnev [et al.] // Polyhedron. - 2017. - Vol. 134. - P. 120-125, DOI 10.1016/j.poly.2017.06.002. - Cited References: 25 . - ISSN 0277-5387
   Перевод заглавия: Координационные эффекты в гидратах 1,3-диэтил-2-тиобарбитуратов марганца(II) и их термическая стабильность
Кл.слова (ненормированные):
1,3-Diethyl-2-thiobarbituric acid -- Complexes -- X-ray diffraction -- Infrared spectroscopy -- Manganese(II)
Аннотация: Three new complexes of 1,3-diethyl-thiobarbituric acid (HDetba), barbiturate-bridged 2D Mn(II) polymer [Mn(H2O)2(Detba)2] (1), trinuclear [Mn3(H2O)10(Detba)6] (2) and discrete molecular [Mn(H2O)4(Detba)2]·H2O (3) are synthesized and structurally characterized by the X-ray single crystal technique. In 1–3, the Detba− ions are coordinated to Mn(II) only through O atoms with manganese ions in the octahedral environment. In 1, the Mn(II) ion is coordinated by four μ2 bridge Detba− ions and two terminal H2O molecules. In 2, the Mn1 ion is coordinated by three terminal H2O molecules, two terminal and one μ2 bridge Detba− ion, and Mn2 is connected with two μ2-Detba− ions and four H2O molecules. In 3, the Mn(II) ion is coordinated by two terminal Detba− ions and four terminal H2O molecules. There are intermolecular hydrogen bonds O–H⋯O, O–H⋯S in the structures of 1–3 which form the 3D networks. Structure 2 is stabilized by the π–π interaction. The compounds thermal decomposition comprises dehydration steps and the organic ligand oxidation.

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Держатели документа:
Department of Chemistry, Siberian Federal University, 79 Svobodny Ave., Krasnoyarsk, Russian Federation
Laboratory of Crystal Physics, Kirensky Institute of Physics, Federal Research Center KSC SB RAS, bld. 38 Akademgorodok 50, Krasnoyarsk, Russian Federation
Department of Engineering Physics and Radioelectronic, Siberian Federal University, 79 Svobodny Ave., Krasnoyarsk, Russian Federation
Department of Physics, Far Eastern State Transport University, 47 Seryshev Str., Khabarovsk, Russian Federation
Laboratory of Physical Chemistry, Irkutsk Favorsky Institute of Chemistry, SB RAS, 1 Favorsky, Irkutsk, Russian Federation
Laboratory of Optical Materials and Structures, Institute of Semiconductor Physics, SB RAS, Novosibirsk, Russian Federation
Laboratory of Semiconductor and Dielectric Materials, Novosibirsk State University, Novosibirsk, Russian Federation

Доп.точки доступа:
Golovnev, N. N.; Molokeev, M. S.; Молокеев, Максим Сергеевич; Sterkhova, I. V.; Lesnikov, M. K.; Atuchin, V. V.
}
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10.

Golovnev, N. N.
Structure of two new compounds of fluoroquinolone antibiotics with mineral acids / N. N. Golovnev, A. D. Vasil’ev // Russ. J. Inorg. Chem. - 2016. - Vol. 61, Is. 11. - P. 1419-1422, DOI 10.1134/S0036023616110073. - Cited References: 19 . - ISSN 0036-0236
Кл.слова (ненормированные):
Single crystals -- X ray diffraction -- Crystallographic data -- Fluoroquinolone antibiotics -- Intra- and intermolecular hydrogen bonds -- Levofloxacin -- Mineral acid -- Pi interactions -- Space Groups -- Sparfloxacin -- Hydrogen bonds
Аннотация: New compounds of sparfloxacin (C19H22F2N4O3, SfH) and levofloxacin (C18H20FN3O4, LevoH) with mineral acids, namely, sparfloxacinium bromide (SfH · HBr, I) and levofloxacindium diperchlorate (LevoH · 2HClO4, II), have been synthesized and characterized by X-ray diffraction. Crystallographic data are a = 7.7151(7) Å, , b = 26.109(3) Å,с = 10.008(1) Å, β = 103.556(1)°, V = 1959.7(3) Å3, space group P21/n, Z = 4 for I and a = 9.727(6) Å, b = 20.440(12) Å, с = 12.286(7) Å, β = 104.327(8)°, V = 2367(2)Å3, space group P21, Z = 4 for II. The structures of these compounds are stabilized by intra- and intermolecular hydrogen bonds and π–π interaction between SfH2 + or LevoH3 2+ ions. © 2016, Pleiades Publishing, Ltd.

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Публикация на русском языке Головнев, Николай Николаевич. Структура двух новых соединений фторхинолоновых антибиотиков с минеральными кислотами [Текст] / Н. Н. Головнев, А. Д. Васильев // Журн. неорг. химии : Наука, 2016. - Т. 61 № 11. - С. 1472-1475

Держатели документа:
Siberian Federal University, Svobodnyi pr. 79, Krasnoyarsk, Russian Federation
Kirenskii Institute of Physics, Siberian Branch, Russian Academy of Sciences, Akademgorodok 50/38, Krasnoyarsk, Russian Federation

Доп.точки доступа:
Vasil'ev, A. D.; Васильев, Александр Дмитриевич; Головнев, Николай Николаевич
}
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11.

Структура ионных сокристаллов 2-тиобарбитурат пиперидиния-2 тиобарбитуровая кислота / Н. Н. Головнёв [и др.] // Журн. структ. химии. - 2016. - Т. 57, № 6. - С. 1330-1333, DOI 10.15372/JSC20160628. - Библиогр.: 22 . - ISSN 0136-7463
Кл.слова (ненормированные):
структура -- ионные сокристаллы -- 2-тиобарбитуровая кислота -- пиперидин -- водородные связи -- ИК спектроскопия -- structure -- ionic cocrystals -- 2-Thiobarbituric acid -- piperidine -- hydrogen bonds -- IR spectroscopy
Аннотация: Определена структура ионных сокристаллов 2-тиобарбитурата пиперидиния с 2-тиобарбитуровой кислотой PipeH+(HTBA-)H2TBA (I) (Н2ТВА - 2-тиобарбитуровая кислота, Pipe - пиперидин). Независимая часть ячейки I содержит молекулу H2TBA в виде тионмонокарбонильного таутомера, ион HTBA- и ион пиперидиния PipeH+. Структура стабилизирована межмолекулярными водородными связями (ВС) O-H···O, N-H···S и N-H···O, образующими трехмерный каркас. Результаты РСА и ИК спектроскопии указывают на образование сильной ВС O-H···O. Проведен топологический анализ сети ВС в I.

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Переводная версия Structure of ionic cocrystals piperidinium 2-thiobarbiturate–2-thiobarbituric acid [Текст] / N. N. Golovnev [et al.] // J. Struct. Chem. : MAIK Nauka-Interperiodica / Springer, 2016. - Vol. 57 Is. 6.- P.1266-1269

Держатели документа:
Дальневосточный государственный университет путей сообщения
Институт физики им. Л.В. Киренского СО РАН
Иркутский институт химии им. А.Е. Фаворского СО РАН
Красноярский государственный аграрный университет
Сибирский федеральный университет

Доп.точки доступа:
Головнёв, Николай Николаевич; Golovnev N.N.; Молокеев, Максим Сергеевич; Molokeev, M. S.; Стерхова, Ирина Владимировна; Sterkhova I.V.; Головнёва, Ирина Ивановна; Golovneva I.I.
}
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12.

    Influence of alkyl substituents in 1,3-diethyl-2-thiobarbituric acid on the coordination environment in M(H2O)2(1,3-diethyl-2-thiobarbiturate)2 M = Ca2+, Sr2+ / N. N. Golovnev [et al.] // J. Coord. Chem. - 2016. - Vol. 69, Is. 6. - P. 957-965, DOI 10.1080/00958972.2016.1149168. - Cited References: 42. - The study was carried out within the public task of the Ministry of Education and Science of the Russian Federation for research engineering of the Siberian Federal University in 2015-2016. V.V.A. is grateful to the Ministry of Education and Science of the Russian Federation for the financial support of the investigation. . - ISSN 0095-8972
   Перевод заглавия: Влияние алкильных заместителей в 1,3-диэтил-2-2тиобарбитуровой кислоты на координационное окружение в M(H2O)2(1,3-диэтил-2-тиобарбутурат)2 M = Ca2+, Sr2+

РУБ Chemistry, Inorganic & Nuclear
Рубрики:
CRYSTAL-STRUCTURE
   2-THIOBARBITURIC ACID
   STRUCTURAL-CHARACTERIZATION
   THIOBARBITURIC ACID
   THERMAL-PROPERTIES
   HYDROGEN-BOND
   COMPLEXES
   DIFFRACTION
   NETWORKS
   POLYMERS
Кл.слова (ненормированные):
1,3-Diethyl-2-thiobarbituric acid -- alkaline earth metals -- coordination compound -- X-ray diffraction -- thermal analysis
Аннотация: Two new isostructural complexes, [Ca(H2O)2(μ2-Detba-O,O′)2]n (1) and [Sr(H2O)2(μ2-Detba-O,O′)2]n (2) (HDetba = 1,3-diethyl-2-thiobarbituric acid), were synthesized and characterized by single-crystal and powder X-ray diffraction analysis, TG-DSC, FT-IR, and emission spectroscopy. The single-crystal X-ray diffraction data revealed that 1 and 2 are polymeric where M2+ (M = Ca, Sr) is a six-coordinate octahedral binding four Detba− ions and two water molecules. The octahedra are linked through bridging Detba− ions forming a 2-D layer. Two intermolecular hydrogen bonds O–H…S in the crystal form a 3-D net. The comparison of M(Detba)2 and M(Htba)2 (H2tba = 2-thiobarbituric acid) structures showed that the coordination number of metals in M(Detba)2 does not exceed six and there are no π–π interactions, unlike compounds with Htba−; Detba− ions are only bridges in HDetba coordination compounds. Thermal decomposition of 1 and 2 includes dehydration, which mainly ends at 200 °C, and organic ligand oxidation at 300–350 °C with a release of CO2, SO2, H2O, NH3, and isocyanate. Upon excitation at 220 nm, 1 and 2 exhibit an intense emission maximum at 557 nm.

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Держатели документа:
Department of Chemistry, Siberian Federal University, Krasnoyarsk, Russian Federation
Laboratory of Crystal Physics, Kirensky Institute of Physics, Krasnoyarsk, Russian Federation
Department of Physics, Far Eastern State Transport University, Khabarovsk, Russian Federation
Laboratory of Optical Materials and Structures, Institute of Semiconductor Physics, Novosibirsk, Russian Federation
Functional Electronics Laboratory, Tomsk State University, Tomsk, Russian Federation
Laboratory of Semiconductor and Dielectric Materials, Novosibirsk State University, Novosibirsk, Russian Federation

Доп.точки доступа:
Golovnev, N. N.; Головнёв, Николай Николаевич; Molokeev, M. S.; Молокеев, Максим Сергеевич; Samoilo, A. S.; Atuchin, V. V.
}
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13.

    Hydrates [Na2(H2O)x](2-thiobarbiturate)2 (x = 3, 4, 5): crystal structure, spectroscopic and thermal properties / N. N. Golovnev [et al.] // J. Coord. Chem. - 2016. - Vol. 69, Is. 21. - P. 3219-3230, DOI 10.1080/00958972.2016.1228914. - Cited References:33. - This work was supported by the the Ministry of Education and Science of the Russian Federation for research engineering of the Siberian Federal University [grant number 3049]. . - ISSN 0095-8972. - ISSN 1029-0389
   Перевод заглавия: Гидраты [Na2(H2O)x](2-thiobarbiturate)2 (x = 3, 4, 5): кристаллическая структура, спектроскопические и термические свойства

РУБ Chemistry, Inorganic & Nuclear
Рубрики:
2-THIOBARBITURIC ACID
   COMPLEXES
   1,3-DIETHYL-2-THIOBARBITURATE
   TRANSFORMATION
   CESIUM
   Na
   Li
Кл.слова (ненормированные):
2-Thiobarbituric acid -- Sodium -- coordination compound -- X-ray diffraction -- infrared spectroscopy -- thermal analysis
Аннотация: The hydrates [Na2(H2O)3(Htba)2] (1) and [Na2(H2O)4(Htba)2] (2), where H2tba is 2-thiobarbituric acid, were obtained under different thermal conditions from aqueous solutions and were structurally characterized. The molecular and supramolecular structures were compared to the known structure of [Na2(H2O)5(Htba)2] (3). In polymeric 1–3, the Htba− ions are linked to Na+ through O and S forming octahedra. The decrease of the number of coordination water molecules led to an increase of the total number of bridge ligands (μ2-H2O, Htba−) and a change of the Htba− coordination. These factors induced higher distortion of the octahedra. It was assumed that hydrates, with a different number of coordinated water molecules, are more probable when the central metal has weaker bonds with O water molecules and with other ligands. The net topologies of 1–3 were compared. Thermal decomposition and IR spectra were analyzed for 1 and 2.

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Держатели документа:
Siberian Fed Univ, Dept Chem, Krasnoyarsk, Russia.
Kirensky Inst Phys, Lab Crystal Phys, Krasnoyarsk, Russia.
Far Eastern State Transport Univ, Dept Phys, Khabarovsk, Russia.
Irkutsk Favorsky Inst Chem, Lab Phys Chem, Irkutsk, Russia.
Inst Semicond Phys, Lab Opt Mat & Struct, Novosibirsk, Russia.
Tomsk State Univ, Funct Elect Lab, Tomsk, Russia.
Novosibirsk State Univ, Lab Semicond & Dielect Mat, Novosibirsk, Russia.

Доп.точки доступа:
Golovnev, N. N.; Molokeev, M. S.; Молокеев, Максим Сергеевич; Sterkhova, Irina V.; Atuchin, V. V.; Sidorenko, Maxim Y.; Ministry of Education and Science of the Russian Federation [3049]
}
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14.

    Bis(μ3-barbiturato−O,O,O′)-(μ2-aqua)- aqua-barium(II): crystal structure, spectroscopic and thermal properties / L. A. Solovyov [et al.] // J. Coord. Chem. - 2017. - Vol. 70, Is. 12. - P. 1984-1993, DOI 10.1080/00958972.2017.1319943. - Cited References: 21 . - ISSN 0095-8972
   Перевод заглавия: Бис(μ3-барбитурат-O,O,O')-(μ2-аква)-аква-бария(II): Кристаллическая структура, спектроскопические и термические свойства
Кл.слова (ненормированные):
Barbituric acid -- barium -- coordination compound -- X-ray diffraction -- infrared spectroscopy -- thermal analysis
Аннотация: A polymeric coordination compound, [Ba(H2O) 2(Hba)2] (1) (H2ba – barbituric acid, C4H4N2O3), was obtained. The structure of 1 was solved using powder X-ray diffraction methods. The Ba2+ ion in 1 formed a three-capped trigonal prism. The BaO9 polyhedra, connected with each other by the edges and faces, formed a chain. Several 4- and 12-membered cycles due to the bridging μ2-H2O and bridging μ3-Hba– also formed implementing a 3-D polymer structure. The structures of 1 and other thiobarbiturate complexes were compared. The replacement of a S atom by an O atom in the heterocyclic ligand Htba− (thiobarbiturate ion) of the compound Ba(H2O)2(Htba)2 resulted in changes of the coordination number Ba(II) and supramolecular structure. The intermolecular hydrogen bonds O–H⋯O and N–H⋯O formed a 3-D net where pronounced 2-D layers of Hba– ions could be found. A new topological net in 1 was observed. The IR and thermal stability were investigated.

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Держатели документа:
Institute of Chemistry and Chemical Technology, SB RAS, FRC “Krasnoyarsk Science Center SB RAS”, Krasnoyarsk, Russian Federation
Department of Chemistry, Siberian Federal University, Krasnoyarsk, Russian Federation
Laboratory of Crystal Physics, Kirensky Institute of Physics, Federal Research Center KSC SB RAS, Krasnoyarsk, Russian Federation
Department of Physics, Far Eastern State Transport University, Khabarovsk, Russian Federation

Доп.точки доступа:
Solovyov, L. A.; Golovnev, N. N.; Molokeev, M. S.; Молокеев, Максим Сергеевич; Lesnikov, M. K.
}
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15.

Crystal structure and properties of polymeric hexaaqua-hexakis-(2-thiobarbiturato)-disamarium(III) / N. N. Golovnev [et al.] // J. Struct. Chem. - 2017. - Vol. 58, Is. 3. - P. 539-543, DOI 10.1134/S0022476617030155. - Cited References: 17 . - ISSN 0022-4766
Кл.слова (ненормированные):
structure -- synthesis -- complex -- 2-thiobarbituric acid -- samarium(III) -- thermal decomposition -- IR spectrum
Аннотация: The structure (CIF file CCDC No. 1401886) of the hexaaqua-hexakis(2-thiobarbiturato)-disamarium [Sm2(H2O)6(HTBA)6]n polymeric complex (I), where H2ТВА is 2-thiobarbituric acid, is determined; its thermal decomposition and IR spectrum are studied. The crystals of I are monoclinic: a = 14.072(1) Å, b = 10.0842(6) Å, c = 15.323(1) Å, β = 110.408(2)°, V = 2037.9(2) Å3, space group P2/n, Z = 2. All three independent thiobarbiturate anions HTBA– coordinate to Sm3+ through oxygen atoms. To one of independent Sm3+ ions six (two terminal and four bridging) HTBA– ions and two water molecules are coordinated; the second is bonded with four bridging HTBA– and four water molecules, forming square antiprisms. The bridging HТВА–anions arrange antiprisms in layers. The structure is stabilized by hydrogen bonds and a π–π interaction between the HТВА– ions. The topology of the polymer network of I is analyzed.

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Публикация на русском языке Кристаллическая структура и свойства полимерного гексааква-гексакис(2-тиобарбитурато)-дисамария(III) [Текст] / Н. Н. Головнев [и др.] // Журн. структ. химии. - 2017. - Т. 58 № 3. - С. 567-571

Держатели документа:
Siberian Federal University, Krasnoyarsk, Russian Federation
Kirensky Institute of Physics, Siberian Branch, Russian Academy of Sciences, Krasnoyarsk, Russian Federation
Far Eastern State Transport University, Khabarovsk, Russian Federation
Favorsky Institute of Chemistry, Siberian Branch, Russian Academy of Sciences, Irkutsk, Russian Federation
Institute of Chemistry and Chemical Technology, Siberian Branch, Russian Academy of Sciences, Krasnoyarsk, Russian Federation
Krasnoyarsk State Agrarian University, Krasnoyarsk, Russian Federation

Доп.точки доступа:
Golovnev, N. N.; Molokeev, M. S.; Молокеев, Максим Сергеевич; Sterkhova, I. V.; Vereshchagin, S. N.; Golovneva, I. I.
}
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16.

Structure of ionic cocrystals piperidinium 2-thiobarbiturate–2-thiobarbituric acid / N. N. Golovnev [et al.] // J. Struct. Chem. - 2016. - Vol. 57, Is. 6. - P. 1266-1269, DOI 10.1134/S0022476616060287. - Cited References: 20 . - ISSN 0022-4766
Кл.слова (ненормированные):
structure -- ionic cocrystals -- 2-thiobarbituric acid -- piperidine -- hydrogen bonds -- IR spectroscopy
Аннотация: The structure of ionic cocrystals of piperidinium 2-thiobarbiturate with 2-thiobarbituric acid PipeH+(HTBA−)H2TBA (I) (H2TBA is 2-thiobarbituric acid, Pipe is piperidine) is determined. The asymmetric unit of I contains a H2TBA molecule in the form of thionemonocarbonyl tautomer, the HTBA–ion, and the PipeH+ piperidinium ion. The structure is stabilized by the intermolecular O–H•••O, N–H•••S, and N–H•••O hydrogen bonds (HBs) forming a three-dimensional framework. The results of single crystal XRD and IR spectroscopy indicate the formation of strong O–H•••O HB. The topological analysis of the HB network in I is performed.

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Публикация на русском языке Структура ионных сокристаллов 2-тиобарбитурат пиперидиния-2 тиобарбитуровая кислота [Текст] / Н. Н. Головнёв [и др.] // Журн. структ. химии. - 2016. - Т. 57 № 6. - С. 1330-1333

Держатели документа:
Siberian Federal University, Krasnoyarsk, Russian Federation
Kirensky Institute of Physics, Siberian Branch, Russian Academy of Sciences, Krasnoyarsk, Russian Federation
Far Eastern State Transport University, Khabarovsk, Russian Federation
Favorsky Institute of Chemistry, Siberian Branch, Russian Academy of Sciences, Irkutsk, Russian Federation
Krasnoyarsk State Agrarian University, Khabarovsk, Russian Federation

Доп.точки доступа:
Golovnev, N. N.; Molokeev, M. S.; Молокеев, Максим Сергеевич; Sterkhova, I. V.; Golovneva, I. I.
}
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17.

Structure of tetrakis((1,3-diethyl-2-thiobarbiturato)(butanol-1))dicobalt(II) / N. N. Golovnev [et al.] // Russ. J. Coord. Chem. - 2017. - Vol. 43, Is. 2. - P. 82-85, DOI 10.1134/S1070328417010031. - Cited References: 21. - This work was carried out at the Siberian Federal University in terms of the state task of the Ministry of Education and Science of the Russian Federation for 2014–2016 (project no. 3049). . - ISSN 1070-3284
Кл.слова (ненормированные):
cobalt(II) -- 1,3-diethyl-2-thiobarbituric acid -- butanol-1 -- dimeric complex -- structure -- IR spectrum
Аннотация: The structure of the dimeric complex [Co2(BuOH)4(Detba)4] (I), where НDetba is 1,3-diethyl-2-thiobarbituric acid, and BuOH is butanol-1, is determined (CIF file CCDC 1475273), and its IR spectrum is studied. The crystals are monoclinic: a = 10.7185(5), b = 21.985(1), c = 12.7235(7) Å, β = 92.196(2)°, V = 2996.1(3) Å3, space group P21/c, Z = 2. The Co2+ ions in compound I are joined in pairs by bridging ligands μ2-Detba–−O,O'. In addition, each of them is linked through the O atoms to one terminal Detba–ion and two BuOH molecules to form a trigonal bipyramid СоО5. Hydrogen bonds O–H···O formed by BuOH and Detba– join the binuclear complexes into an infinite chain. The data of IR spectroscopy are consistent with the results of X-ray diffraction analysis.

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Публикация на русском языке Структура тетракис((1,3-диэтил-2-тиобарбитурато)-(бутанол-1))-дикобальта(II) [Текст] / Н. Н. Головнев [и др.] // Координ. химия : Наука, 2017. - Т. 43 № 2. - С. 81-84

Держатели документа:
Siberian Federal University, Krasnoyarsk, Russian Federation
Kirensky Institute of Physics, Siberian Branch, Russian Academy of Sciences, Akademgorodok, Krasnoyarsk, Russian Federation
Far East State Transport University, Khabarovsk, Russian Federation
Nikolaev Institute of Inorganic Chemistry, Siberian Branch, Russian Academy of Sciences, Novosibirsk, Russian Federation
Novosibirsk National Research State University, Novosibirsk, Russian Federation

Доп.точки доступа:
Golovnev, N. N.; Molokeev, M. S.; Молокеев, Максим Сергеевич; Smolentsev, A. I.; Lesnikov, M. K.
}
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18.

    Two novel mixed-ligand Ni(II) and Co(II) complexes with 1,10-phenanthroline: Synthesis, structural characterization, and thermal stability / N. N. Golovnev [et al.] // Chem. Phys. Lett. - 2018. - Vol. 708. - P. 11-16, DOI 10.1016/j.cplett.2018.07.058. - Cited References: 29. - The study was carried out within the public task of the Ministry of Education and Science of the Russian Federation to the Siberian Federal University (4.7666.2017/BP) in 2017-2019. X-ray data from single crystals were obtained with use the analytical equipment of Baikal Center of collective use of SB RAS and with use the analytical equipment of Krasnoyarsk Center of collective use of SB RAS. . - ISSN 0009-2614
   Перевод заглавия: Два новых комплекса смешанных лигандов Ni (II) и Co (II) с 1,10-фенантролином: синтез, структурная характеризация и термическая стабильность
Кл.слова (ненормированные):
Barbituric acid -- 1,10-Phenanthroline complexes -- X-ray diffraction -- Thermal decomposition -- Infrared spectroscopy
Аннотация: Two nickel(II) and cobalt(II) complexes with phenanthroline, [Ni(Phen)(H2O)3Br]Br (1) and [Co(Phen)2(H2O)2](Hba)2·2H2O (2), Phen = 1,10-phenanthroline and Hba− = barbiturate anion, were synthesized and characterized by powder XRD, TGA and FT-IR. Their structures were determined by single crystal X-ray diffraction techniques. The Ni2+ ion is coordinated by two N atoms of Phen molecule, Br− ion and three H2O molecules forming an octahedron. Uncoordinated and coordinated Br− ions are connected with water molecules by OH⋯Br intermolecular hydrogen bonds with the formation of a 2D plane network which is extended into a 3D network by π−π stacking interactions. The [Co(Phen)2(H2O)2]2+ cation contains a six-coordinated cobalt atom chelated by two Phen ligands and two aqua ligands in the cis arrangement. NH⋯O, OH⋯O and CH⋯O intermolecular hydrogen bonds form a 3D net. NH⋯O hydrogen bonds form the infinite chains of Hba–. In addition, coordinated Phen molecules and lattice water molecules are linked via CH⋯OW hydrogen bonds to form infinite zigzag chains. These different chains are connected by OWH⋯O hydrogen bonds. π−π interaction plays an important role in the stabilization of structures 1–2. FT-IR, TGA, the diffuse reflectance, and UV–Vis spectra were also used to characterize these compounds.

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Держатели документа:
Siberian Federal University, 79 Svobodny Ave., Krasnoyarsk, Russian Federation
Laboratory of Crystal Physics, Kirensky Institute of Physics, Federal Research Center KSC SB RAS, bld. 38 Akademgorodok 50, Krasnoyarsk, Russian Federation
Department of Physics, Far Eastern State Transport University, 47 Seryshev Str., Khabarovsk, Russian Federation
Favorsky Institute of Chemistry, Siberian Branch, Russian Academy of Sciences, 1 Favorsky, Irkutsk, Russian Federation

Доп.точки доступа:
Golovnev, N. N.; Molokeev, M. S.; Молокеев, Максим Сергеевич; Sterkhova, I. V.; Lesnikov, M. K.
}
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19.

    Role of metal-chloride anions in photoluminescence regulations for hybrid metal halides / B. Su, G. Song, M. S. Molokeev [et al.] // J. Phys. Chem. Lett. - 2021. - Vol. 12, Is. 7. - P. 1918-1925, DOI 10.1021/acs.jpclett.1c00182. - Cited References: 40. - This work is supported by the National Natural Science Foundation of China (51961145101 and 51972118), the Fundamental Research Funds for the Central Universities (D2190980), the Guangzhou Science & Technology Project (202007020005), and the Local Innovative and Research Teams Project of Guangdong Pearl River Talents Program (2017BT01X137). This work is also funded by RFBR according to the research project No. 19-52-80003 . - ISSN 1948-7185
   Перевод заглавия: Роль металл-хлорид-анионов в регуляции фотолюминесценции гибридных галогенидов металлов
Кл.слова (ненормированные):
Intra-molecular hydrogen bonds -- Intramolecular interactions -- Luminescence mechanisms -- Organic-inorganic hybrid -- Photoluminescence properties -- Photoluminescence quantum yields -- Photophysical properties -- Structural diversity -- Metal halides
Аннотация: Organic–inorganic hybrid metal halides with emissive organic cations are of great interest due to their structural diversity and interesting photophysical properties. Here, we assemble emissive organic cations (EnrofloH22+) with different metal–chloride anions (Pb2Cl62– to Bi2Cl104– to SnCl62–) to form the new single crystal phases, and thus the photoluminescence properties of the metal halides, including Stokes shift, full width at half-maximum (FWHM), and photoluminescence quantum yield (PLQY) have been studied accordingly. (EnrofloH2)SnCl6·H2O, as an example, possesses narrow FWHM and high PLQY, which are caused by the strong π–π stacking and inter- and intramolecular hydrogen bonds interactions. Compared with EnrofloH22+ cation in solution, the interactions generate a restraining effect and increase the rigid degree of EnrofloH22+ cation in the bulk single crystals. Our work clarifies the photophysical properties of the EnrofloH22+ organic cations by constructing the inter- and intramolecular interactions and boosts the further study of organic–inorganic hybrid metal halides materials with different luminescence mechanisms.

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Держатели документа:
The State Key Laboratory of Luminescent Materials and Devices, Guangdong Provincial Key Laboratory of Fiber Laser Materials and Applied Techniques, School of Materials Science and Technology, South China University of Technology, Guangzhou, 510640, China
Technical Institute of Physics and Chemistry, University of Chinese Academy of Sciences, Beijing, 100190, China
Center of Materials Science and Optoelectronics Engineering, University of the Chinese Academy of Sciences, Beijing, 100049, China
Laboratory of Crystal Physics, Kirensky Institute of Physics, Federal Research Center KSC SB RAS, Krasnoyarsk, 660036, Russian Federation
Siberian Federal University, Krasnoyarsk, 660041, Russian Federation
Research and Development Department, Kemerovo State University, Kemerovo, 650000, Russian Federation

Доп.точки доступа:
Su, B.; Song, G.; Molokeev, M. S.; Молокеев, Максим Сергеевич; Golovnev, N. N.; Lesnikov, M. K.; Lin, Z.; Xia, Z.
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20.

Golovnev, N. N.
Structure of two novel fluoroquinolone salts / N. N. Golovnev, A. D. Vasiliev, A. V. Demina // J. Struct. Chem. - 2021. - Vol. 62, Is. 2. - P. 236-243, DOI 10.1134/S0022476621020074. - Cited References: 23. - The reported study was funded by RFBR, project number 19-52-80003 . - ISSN 0022-4766
Кл.слова (ненормированные):
ciprofloxacinium dichloride -- tetrakis(levofloxacin) tris{hexachlorostannate(IV)} dichloride -- synthesis -- structure -- properties
Аннотация: Fluoroquinolone compounds with the composition CfH2+2, 2Cl–, H2O (CfH2Cl2·H2O (I)) and 4LevoH2+2, 3[SnCl6]2–, 2Cl–, 2H2O ((LevoH2)4[SnCl6]3Cl2·2H2O (II)) (Cf is ciprofloxacin, Levo is levofloxacin) are prepared. Their structures are determined by XRSCD. Crystals I are monoclinic: a = 8.6389(11) Å, b = 14.5486(19) Å, c = 14.8605(19) Å, β = 91.914(3)°, V = 1866.7(4) Å3, space group P21/c, Z = 4. Crystals II are triclinic: a = 12.4821(8) Å, b = 13.8144(8) Å, c = 15.2342(9) Å, α = 84.360(1)°, β = 79.265(1)°, γ = 74.038(1)°, V = 2478.3(3) Å3, space group P1, Z = 1. The structures are stabilized by multiple hydrogen bonds. The photoluminescent properties and thermal stability of compound I are considered.

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Публикация на русском языке Головнев Н. Н. Структура двух новых солей фторхинолонов [Текст] / Н. Н. Головнев, А. Д. Васильев, А. В. Демина // Журн. структ. химии. - 2021. - Т. 62 № 2. - С. 250-257

Держатели документа:
Siberian Federal University, Krasnoyarsk, Russian Federation
Kirensky Institute of Physics, Federal Research Center KSC SB RAS, Krasnoyarsk, Russian Federation

Доп.точки доступа:
Vasiliev, A. D.; Васильев, Александр Дмитриевич; Demina, A. V.
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