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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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    Photoluminescence of pefloxacindi-ium manganese(II) and zinc(II) tetrahalides / N. N. Golovnev, M. A. Gerasimova, M. S. Molokeev [et al.] // J. Mol. Struct. - 2022. - Vol. 1248. - Ст. 131468, DOI 10.1016/j.molstruc.2021.131468. - Cited References: 42. - The research was funded by RFBR, Krasnoyarsk Territory and Krasnoyarsk Regional Fund of Science, project number 20-43-240007. Authors thank the Centre for Equipment Joint User of School of Petroleum and Natural Gas Engineering of Siberian Federal University, Institute of Chemistry and Chemical Technology SB RAS for their technical support . - ISSN 0022-2860
   Перевод заглавия: Фотолюминесценция тетрагалогенидов марганца(II) и цинка(II) пефлоксацина
Кл.слова (ненормированные):
Manganese and zinc halides -- Pefloxacin -- Ionic compounds -- Photoluminescence -- X-ray diffraction -- Thermal decomposition
Аннотация: Mn2+-based hybrid materials have become the hotspot of current research studies owing to their high photoluminescence quantum yield (PLQY), low-cost, environmental friendliness and stability. For the first time, we report the hydrothermal synthesis of two lead-free zero-dimensional luminescent organic-inorganic hybrid compounds, PefH2[MnBr4] (1) and PefH2[MnCl4] (2) (Pef = pefloxacin). They were characterized by elemental analysis, TG-DSC, single-crystal and powder XRD. Compounds 1–2 exhibit a distorted tetrahedral geometry around the manganese(II) metal center, which is isolated from the same centers by bulky pefloxacindi-ium (PefH22+) ions with a Mn···Mn distance of 7.3 Å. Their structures are stabilized by N—H···O, O—H···X (X = Br, Cl), C—H···O and C—H···X hydrogen bands and π–π stacking interaction. Thermal decomposition starts at T › 230°С for 1 and T › 210°С for 2 and proceeds for several stages. Upon UV excitation compounds exhibit a bright green emission with a moderate PLQY of 45% for 1 and 30% for 2. The influence of the halide ion and metal ion on the photoluminescence properties of isostructural compounds PefH2[MX4] (M = Mn, Zn and X = Br, Cl) is discussed.

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Держатели документа:
Siberian Federal University, 79 Svobodny Prospect, Krasnoyarsk, 660041, Russian Federation
Laboratory of Crystal Physics, Kirensky Institute of Physics, Federal Research Center KSC SB RAS, bld. 38 Akademgorodok 50, Krasnoyarsk, 660036, Russian Federation
Department of Physics, Far Eastern State Transport University, 47 Seryshev Str., Khabarovsk, 680021, Russian Federation
Research and Development Department, Kemerovo State University, 6 Krasnaya Str., Kemerovo, 650000, Russian Federation

Доп.точки доступа:
Golovnev, N. N.; Gerasimova, M. A.; Molokeev, M. S.; Молокеев, Максим Сергеевич; Plyaskin, M. E.; Baronin, M. E.
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