Crystallography Open Database
Search results
Result: there are 28115 entries in the selection
Switch to the old layout of the pageDownload all results as: list of COD numbers | list of CIF URLs | data in CSV format
We are unable to provide that many records as a single archive.
You can instead download the entire COD archive as a single .zip, .tgz or .txz archive.
Searching journal of publication like 'CrystEngComm'
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
---|---|---|---|---|---|---|
7245902 | CIF | Ag Cr2 H4 O10 Sc | P -1 | 5.586; 6.054; 7.432 110.74; 90.21; 117.34 | 204.564 | Popa, Marcel Mirel; Shova, Sergiu; Dascalu, Mihaela; Caira, Mino R.; Dumitrascu, Florea Crystal structures of 5-bromo-1-arylpyrazoles and their halogen bonding features CrystEngComm, 2023, 25, 86-94 |
7200990 | CIF | Ag F3 K | P n m a | 6.2689; 8.3015; 6.1844 90; 90; 90 | 321.844 | Mazej, Zoran; Goreshnik, Evgeny; Jagličić, Zvonko; Gaweł, Bartłomiej; Łasocha, Wiesław; Grzybowska, Dorota; Jaroń, Tomasz; Kurzydłowski, Dominik; Malinowski, Przemysław; Koźminski, Wiktor; Szydłowska, Jadwiga; Leszczyński, Piotr; Grochala, Wojciech KAgF3, K2AgF4 and K3Ag2F7: important steps towards a layered antiferromagnetic fluoroargentate(II), CrystEngComm, 2009, 11, 1702 |
7200988 | CIF | Ag F4 K2 | C m c a | 6.182; 12.632; 6.436 90; 90; 90 | 502.6 | Mazej, Zoran; Goreshnik, Evgeny; Jagličić, Zvonko; Gaweł, Bartłomiej; Łasocha, Wiesław; Grzybowska, Dorota; Jaroń, Tomasz; Kurzydłowski, Dominik; Malinowski, Przemysław; Koźminski, Wiktor; Szydłowska, Jadwiga; Leszczyński, Piotr; Grochala, Wojciech KAgF3, K2AgF4 and K3Ag2F7: important steps towards a layered antiferromagnetic fluoroargentate(II), CrystEngComm, 2009, 11, 1702 |
7211056 | CIF | Ag I3 Mn O9 | P -1 | 8.017; 10.1567; 11.0657 78.156; 89.947; 77.156 | 858.85 | Xu, Xiang; Hu, Chun-Li; Yang, Bing-Ping; Mao, Jiang-Gao Syntheses, crystal structures and magnetic properties of three new silver manganese(ii) or manganese(iii) mixed metal iodates CrystEngComm, 2013, 15, 7776 |
7211057 | CIF | Ag I4 Mn O12 | P -1 | 7.1101; 7.6749; 10.2429 90.078; 103.552; 99.571 | 535.35 | Xu, Xiang; Hu, Chun-Li; Yang, Bing-Ping; Mao, Jiang-Gao Syntheses, crystal structures and magnetic properties of three new silver manganese(ii) or manganese(iii) mixed metal iodates CrystEngComm, 2013, 15, 7776 |
7200989 | CIF | Ag2 F7 K3 | C c c a :2 | 20.8119; 6.3402; 6.2134 90; 90; 90 | 819.87 | Mazej, Zoran; Goreshnik, Evgeny; Jagličić, Zvonko; Gaweł, Bartłomiej; Łasocha, Wiesław; Grzybowska, Dorota; Jaroń, Tomasz; Kurzydłowski, Dominik; Malinowski, Przemysław; Koźminski, Wiktor; Szydłowska, Jadwiga; Leszczyński, Piotr; Grochala, Wojciech KAgF3, K2AgF4 and K3Ag2F7: important steps towards a layered antiferromagnetic fluoroargentate(II), CrystEngComm, 2009, 11, 1702 |
7222296 | CIF | Ag2 Mo O4 | F d -3 m :2 | 9.3177; 9.3177; 9.3177 90; 90; 90 | 808.96 | Cunha, F. S.; Sczancoski, J. C.; Nogueira, I. C.; de Oliveira, V. G.; Lustosa, S. M. C.; Longo, E.; Cavalcante, L. S. Structural, morphological and optical investigation of β-Ag2MoO4 microcrystals obtained with different polar solvents CrystEngComm, 2015, 17, 8207 |
7244949 | CIF | Ag3 B6 I O10 | P n m a | 12.7428; 9.5341; 8.5326 90; 90; 90 | 1036.64 | Volkov, Sergey; Charkin, Dmitri O.; Arsentev, Maxim; Aksenov, Sergey; Manelis, Lev; Krzhizhanovskaya, Maria; Sinelshikova, Olga; Ugolkov, Valeriy Leonidovich; Povolotskiy, Alexey; Shilovskikh, Vladimir; Antonov, Andrey; Bubnova, Rimma Where the extraordinaries meet: a cascade of isosymmetrical superionic phase transitions and negative thermal expansion in a novel silver salt-inclusion borate halide CrystEngComm, 2022 |
7244950 | CIF | Ag3 B6 I O10 | P n m a | 12.7477; 9.5347; 8.5287 90; 90; 90 | 1036.63 | Volkov, Sergey; Charkin, Dmitri O.; Arsentev, Maxim; Aksenov, Sergey; Manelis, Lev; Krzhizhanovskaya, Maria; Sinelshikova, Olga; Ugolkov, Valeriy Leonidovich; Povolotskiy, Alexey; Shilovskikh, Vladimir; Antonov, Andrey; Bubnova, Rimma Where the extraordinaries meet: a cascade of isosymmetrical superionic phase transitions and negative thermal expansion in a novel silver salt-inclusion borate halide CrystEngComm, 2022 |
7244951 | CIF | Ag3 B6 I O10 | P n m a | 12.7504; 9.537; 8.5317 90; 90; 90 | 1037.46 | Volkov, Sergey; Charkin, Dmitri O.; Arsentev, Maxim; Aksenov, Sergey; Manelis, Lev; Krzhizhanovskaya, Maria; Sinelshikova, Olga; Ugolkov, Valeriy Leonidovich; Povolotskiy, Alexey; Shilovskikh, Vladimir; Antonov, Andrey; Bubnova, Rimma Where the extraordinaries meet: a cascade of isosymmetrical superionic phase transitions and negative thermal expansion in a novel silver salt-inclusion borate halide CrystEngComm, 2022 |
7244952 | CIF | Ag3 B6 I O10 | P n m a | 12.7702; 9.5617; 8.5156 90; 90; 90 | 1039.8 | Volkov, Sergey; Charkin, Dmitri O.; Arsentev, Maxim; Aksenov, Sergey; Manelis, Lev; Krzhizhanovskaya, Maria; Sinelshikova, Olga; Ugolkov, Valeriy Leonidovich; Povolotskiy, Alexey; Shilovskikh, Vladimir; Antonov, Andrey; Bubnova, Rimma Where the extraordinaries meet: a cascade of isosymmetrical superionic phase transitions and negative thermal expansion in a novel silver salt-inclusion borate halide CrystEngComm, 2022 |
7244954 | CIF | Ag3 B6 I O10 | P n m a | 12.7566; 9.705; 8.4295 90; 90; 90 | 1043.6 | Volkov, Sergey; Charkin, Dmitri O.; Arsentev, Maxim; Aksenov, Sergey; Manelis, Lev; Krzhizhanovskaya, Maria; Sinelshikova, Olga; Ugolkov, Valeriy Leonidovich; Povolotskiy, Alexey; Shilovskikh, Vladimir; Antonov, Andrey; Bubnova, Rimma Where the extraordinaries meet: a cascade of isosymmetrical superionic phase transitions and negative thermal expansion in a novel silver salt-inclusion borate halide CrystEngComm, 2022 |
7244955 | CIF | Ag3 B6 I O10 | P n m a | 12.7726; 9.5739; 8.4899 90; 90; 90 | 1038.18 | Volkov, Sergey; Charkin, Dmitri O.; Arsentev, Maxim; Aksenov, Sergey; Manelis, Lev; Krzhizhanovskaya, Maria; Sinelshikova, Olga; Ugolkov, Valeriy Leonidovich; Povolotskiy, Alexey; Shilovskikh, Vladimir; Antonov, Andrey; Bubnova, Rimma Where the extraordinaries meet: a cascade of isosymmetrical superionic phase transitions and negative thermal expansion in a novel silver salt-inclusion borate halide CrystEngComm, 2022 |
7216410 | CIF | Ag3 Ga3 Se8 Si | I -4 2 d | 5.9041; 5.9041; 10.499 90; 90; 90 | 365.98 | Mei, Dajiang; Gong, Pifu; Lin, Zheshuai; Feng, Kai; Yao, Jiyong; Huang, Fuqiang; Wu, Yicheng Ag3Ga3SiSe8: a new infrared nonlinear optical material with a chalcopyrite structure CrystEngComm, 2014, 16, 6836 |
7211058 | CIF | Ag3 I6 Mn O18 | P -1 | 6.6378; 6.8724; 10.0243 73.544; 72.194; 81.327 | 416.51 | Xu, Xiang; Hu, Chun-Li; Yang, Bing-Ping; Mao, Jiang-Gao Syntheses, crystal structures and magnetic properties of three new silver manganese(ii) or manganese(iii) mixed metal iodates CrystEngComm, 2013, 15, 7776 |
7244324 | CIF | Ag4 H6 N22 | P 1 21/c 1 | 9.0932; 9.1069; 9.8502 90; 108.847; 90 | 772 | Zhang, Xiaopeng; Hou, Tianyang; Lin, Qiuhan; Wang, Pengcheng; Li, Dongxue; Xu, Yuangang; Lu, Ming Fascinating 3D energetic [Ag2(N5)2(EDA)]n: filling the ethylenediamine molecules into [Ag(N5)]n framework CrystEngComm, 2022 |
7245758 | CIF | Al B7 H3 K2.5 Na0.5 O15 | P -1 | 7.0328; 10.1025; 10.5133 102.48; 102.285; 99.917 | 693.72 | Dong, Ya-Zhuo; Chen, Chong-An; Chen, Juan; Cheng, Jian-Wen; Li, Jinhua; Yang, Guo-Yu Two porous-layered borates built by B7O13(OH) clusters and AlO4/GaO4 tetrahedra CrystEngComm, 2022 |
7214849 | CIF | Al Ca Er O4 | I 4/m m m | 3.642; 3.642; 11.814 90; 90; 90 | 156.7 | Zhu, Zhaojie; Zeng, Huiyi; Li, Jianfu; You, Zhenyu; Wang, Yan; Huang, Zixiang; Tu, Chaoyang Growth, structure and spectral properties of a novel crystal CaErAlO4 for 2.7 μm lasers CrystEngComm, 2012, 14, 7423 |
7227257 | CIF | Al Ca Gd O4 | I 4/m m m | 3.6632; 3.6632; 11.998 90; 90; 90 | 161 | Hu, Qiangqiang; Jia, Zhitai; Tang, Cheng; Lin, Na; Zhang, Jian; Jia, Ning; Wang, Shanpeng; Zhao, Xian; Tao, Xutang The origin of coloration of CaGdAlO4 crystals and its effect on their physical properties CrystEngComm, 2017, 19, 537 |
7240207 | CIF | Al H Na O5 P | P 41 21 2 | 8.4509; 8.4509; 4.7354 90; 90; 90 | 338.191 | Hao, Yucheng; Pan, Yang; Lin, Yuan; He, Linbo; Ge, Guangjie; Ruan, Yu; Zhou, Haida; Xue, Yang; Koirala, Kisan Highly Porous Aluminophosphates with Unique Three Dimensional Open Framework Structures from Mild Hydrothermal Syntheses CrystEngComm, 2020 |
7240208 | CIF | Al H Na O5 P | I 4/m m m | 6.1977; 6.1977; 10.3826 90; 90; 90 | 398.81 | Hao, Yucheng; Pan, Yang; Lin, Yuan; He, Linbo; Ge, Guangjie; Ruan, Yu; Zhou, Haida; Xue, Yang; Koirala, Kisan Highly Porous Aluminophosphates with Unique Three Dimensional Open Framework Structures from Mild Hydrothermal Syntheses CrystEngComm, 2020 |
7245782 | CIF | Al H30 N15 O15 | P 1 21/n 1 | 16.7321; 14.5671; 20.0005 90; 92.771; 90 | 4869.2 | Chen, Lei; Yang, Chen; Hu, Haoran; Shi, Lei; Zhang, Chong; Sun, Chengguo; Gao, Chao; Du, Yang; Hu, Bingcheng Synthesis and characterization of cyclo-pentazolate salts of iron(iii) and aluminum(iii) CrystEngComm, 2022 |
7245445 | CIF | Al Li3 O9.5 P2 | P 4 | 10.9897; 10.9897; 5.9946 90; 90; 90 | 723.99 | Li, Xinlei; Zhang, Yang; Pan, Yang; Hao, Yucheng; Lin, Yuan; Li, Haijian; Li, Minghua; Fan, Changzeng; Alekseev, Evgeny V. Li3[Al(PO4)2(H2O)1.5] and Na[AlP2O7]:from 2D Layered Polar to 3D Centrosymmetric Framework Structures CrystEngComm, 2022 |
7245446 | CIF | Al Na O7 P2 | C 1 2/c 1 | 7.396; 9.7388; 8.2067 90; 106.039; 90 | 568.1 | Li, Xinlei; Zhang, Yang; Pan, Yang; Hao, Yucheng; Lin, Yuan; Li, Haijian; Li, Minghua; Fan, Changzeng; Alekseev, Evgeny V. Li3[Al(PO4)2(H2O)1.5] and Na[AlP2O7]:from 2D Layered Polar to 3D Centrosymmetric Framework Structures CrystEngComm, 2022 |
7247107 | CIF | Al O5 P | P -1 | 6.8925; 7.1249; 8.6411 89.34; 67.136; 87.675 | 390.68 | Hao, Yucheng; Zhang, Yang; Zhang, Yuying; Fu, Zixiang; Heng, Chunyang; Li, Junjie; You, Jiatian; Hu, Kunhong; Lin, Yuan; Li, Haijian A series of novel phosphites/phosphates with deep-ultraviolet cut-off edges from 0D polar to 3D non-polar architectures CrystEngComm, 2023, 25, 4864-4872 |
7247106 | CIF | Al O7 P2 | P 63 m c | 5.1806; 5.1806; 12.8377 90; 90; 120 | 298.39 | Hao, Yucheng; Zhang, Yang; Zhang, Yuying; Fu, Zixiang; Heng, Chunyang; Li, Junjie; You, Jiatian; Hu, Kunhong; Lin, Yuan; Li, Haijian A series of novel phosphites/phosphates with deep-ultraviolet cut-off edges from 0D polar to 3D non-polar architectures CrystEngComm, 2023, 25, 4864-4872 |
7240209 | CIF | Al1.17 O6.33 P1.83 | P 63/m | 7.8692; 7.8692; 7.0721 90; 90; 120 | 379.26 | Hao, Yucheng; Pan, Yang; Lin, Yuan; He, Linbo; Ge, Guangjie; Ruan, Yu; Zhou, Haida; Xue, Yang; Koirala, Kisan Highly Porous Aluminophosphates with Unique Three Dimensional Open Framework Structures from Mild Hydrothermal Syntheses CrystEngComm, 2020 |
7240199 | CIF | Al1.271 Ga2.1 Gd3 O12 Sc1.629 | I a -3 d | 12.4372; 12.4372; 12.4372 90; 90; 90 | 1923.84 | Spassky, Dmitry; Kozlova, Nina; Zabelina, Evgeniia; Kasimova, Valentina; Krutyak, Nataliya; Ukhanova, Alisa; Morozov, Vladimir A.; Morozov, Anatolii V.; Buzanov, Oleg; Chernenko, Kirill; Omelkov, Sergey; Nagirnyi, Vitali Influence of the Sc cation substituent on the structural properties and energy transfer processes in GAGG:Ce crystals CrystEngComm, 2020 |
7231865 | CIF | Al13 H12 Na O70 S4 | F -4 3 m | 17.779; 17.779; 17.779 90; 90; 90 | 5619.8 | An, Guangyu; Jiang, Yuqian; Xi, Jinyang; Liu, Libing; Wang, Pin; Xiao, Feng; Wang, Dongsheng Crystallization of aluminum polycation sulfates: transformation of tetrahedral crystals into block crystals in aqueous solutions CrystEngComm, 2019, 21, 202 |
7231864 | CIF | Al13 H53 O67 S3 | P 1 n 1 | 14.03; 11.502; 17.598 90; 102.18; 90 | 2775.9 | An, Guangyu; Jiang, Yuqian; Xi, Jinyang; Liu, Libing; Wang, Pin; Xiao, Feng; Wang, Dongsheng Crystallization of aluminum polycation sulfates: transformation of tetrahedral crystals into block crystals in aqueous solutions CrystEngComm, 2019, 21, 202 |
7210710 | CIF | Al2 Ba3 H6 O18 P6 | R -3 :H | 15.6227; 15.6227; 12.4684 90; 90; 120 | 2635.44 | Wang, Xi-Jia; Zhang, Jian-Han; Song, Jun-Ling; Kong, Fang; Mao, Jiang-Gao Syntheses, crystal structures of a series of novel alkali metal or alkaline earth metal phosphites CrystEngComm, 2013, 15, 2519 |
7240198 | CIF | Al2.3 Ga2.7 Gd3 O12 | I a -3 d | 12.26148; 12.26148; 12.26148 90; 90; 90 | 1843.44 | Spassky, Dmitry; Kozlova, Nina; Zabelina, Evgeniia; Kasimova, Valentina; Krutyak, Nataliya; Ukhanova, Alisa; Morozov, Vladimir A.; Morozov, Anatolii V.; Buzanov, Oleg; Chernenko, Kirill; Omelkov, Sergey; Nagirnyi, Vitali Influence of the Sc cation substituent on the structural properties and energy transfer processes in GAGG:Ce crystals CrystEngComm, 2020 |
7247108 | CIF | Al3 O19.5 P6 | P 63/m | 7.9101; 7.9101; 7.1057 90; 90; 120 | 385.04 | Hao, Yucheng; Zhang, Yang; Zhang, Yuying; Fu, Zixiang; Heng, Chunyang; Li, Junjie; You, Jiatian; Hu, Kunhong; Lin, Yuan; Li, Haijian A series of novel phosphites/phosphates with deep-ultraviolet cut-off edges from 0D polar to 3D non-polar architectures CrystEngComm, 2023, 25, 4864-4872 |
7228729 | CIF | Al4 Co2.323 H24 O40 P8 | P 1 21/n 1 | 8.402; 16.569; 5.108 90; 90; 90 | 711.1 | Zaarour, Moussa; perez, olivier; Boullay, Philippe; Martens, Joern; Mihailova, Boriana D.; Karaghiosoff, Konstantin; Palatinus, Lukáš; Mintova, Svetlana Synthesis of New Framework Cobalt Aluminophosphate by Opening Cobalt Methylphosphonate Layered Material CrystEngComm, 2017 |
7240448 | CIF | Al6 K6 O41.38 P8 | P -3 | 12.925; 12.925; 7.9339 90; 90; 120 | 1147.83 | Maeda, Kazuyuki; Wakui, Kentaro; Arakawa, Kyosuke; Kondo, Atsushi First Preparation of Microporous AFY-type MeAPO by Topotactic Pillaring of Lamellar Aluminophosphate Precursor CrystEngComm, 2020 |
7247566 | CIF | As Br2 La3 S5 | C 1 c 1 | 22.3092; 7.1387; 7.1638 90; 98.471; 90 | 1128.45 | Cicirello, Andrea; Swindle, Andrew; Wang, Jian Visualizing the alignment of lone pair electrons in La3AsS5Br2 and La5As2S9Cl3 to form an acentric or centrosymmetric structure CrystEngComm, 2023, 25, 6354-6360 |
7240704 | CIF | As Co F Sm | P 4/n m m :2 | 3.95554; 3.95554; 8.24623 90; 90; 90 | 129.023 | Lin, Dan; Luo, Qinxin; Zheng, Hui; Tang, Lulu; Zhan, Wenqi; Tang, Kaibin A new oxygen-free cobalt-based compound SmCoAsF with multiple magnetic transitions CrystEngComm, 2020 |
7215353 | CIF | As H4 N O2 | P 1 21/c 1 | 5.24562; 4.73223; 12.3051 90; 90.426; 90 | 305.447 | Guńka, Piotr A.; Dranka, Maciej; Zachara, Janusz Supramolecular structure of ammonium polyoxoarsenates(iii) CrystEngComm, 2011, 13, 6163 |
7215354 | CIF | As H4 N O2 | P 1 21/c 1 | 5.3555; 4.7543; 12.313 90; 90.124; 90 | 313.51 | Guńka, Piotr A.; Dranka, Maciej; Zachara, Janusz Supramolecular structure of ammonium polyoxoarsenates(iii) CrystEngComm, 2011, 13, 6163 |
7247567 | CIF | As2 Cl3 La5 S9 | P b c m | 7.0472; 7.1152; 37.1137 90; 90; 90 | 1860.96 | Cicirello, Andrea; Swindle, Andrew; Wang, Jian Visualizing the alignment of lone pair electrons in La3AsS5Br2 and La5As2S9Cl3 to form an acentric or centrosymmetric structure CrystEngComm, 2023, 25, 6354-6360 |
7241824 | CIF | As2 O3 | P 1 21/n 1 | 5.3224; 12.94547; 4.53602 90; 94.289; 90 | 311.661 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241825 | CIF | As2 O3 | P 1 21/n 1 | 5.2379; 12.75457; 4.49625 90; 94.413; 90 | 299.49 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241826 | CIF | As2 O3 | P 1 21/n 1 | 5.1081; 12.49492; 4.4239 90; 94.591; 90 | 281.45 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241827 | CIF | As2 O3 | P 1 21/n 1 | 5.1421; 12.56168; 4.4451 90; 94.552; 90 | 286.22 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241828 | CIF | As2 O3 | P 1 21/n 1 | 5.0748; 12.42717; 4.4031 90; 94.604; 90 | 276.79 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241829 | CIF | As2 O3 | P 1 21/n 1 | 4.9826; 12.26098; 4.3436 90; 94.581; 90 | 264.51 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241830 | CIF | As2 O3 | P 1 21/n 1 | 5.0087; 12.31139; 4.3629 90; 94.593; 90 | 268.17 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241831 | CIF | As2 O3 | P 1 21/n 1 | 4.6166; 11.5551; 4.0512 90; 94.807; 90 | 215.35 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241832 | CIF | As2 O3 | P 1 21/n 1 | 4.8892; 12.10248; 4.2841 90; 94.569; 90 | 252.69 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241833 | CIF | As2 O3 | P 1 21/n 1 | 4.8627; 12.05705; 4.2663 90; 94.603; 90 | 249.33 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241834 | CIF | As2 O3 | P 1 21/n 1 | 4.7015; 11.7503; 4.1387 90; 94.764; 90 | 227.85 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241835 | CIF | As2 O3 | P 1 21/n 1 | 4.8883; 12.1119; 4.28963 90; 94.6135; 90 | 253.15 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241836 | CIF | As2 O3 | P 1 21/n 1 | 5.1811; 12.63631; 4.46609 90; 94.516; 90 | 291.49 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241837 | CIF | As2 O3 | P 1 21/n 1 | 4.5713; 11.4696; 4.007 90; 94.792; 90 | 209.36 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241838 | CIF | As2 O3 | P 1 21/n 1 | 5.07859; 12.4595; 4.41318 90; 94.5756; 90 | 278.36 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241839 | CIF | As2 O3 | P 1 21/n 1 | 4.6442; 11.6134; 4.07822 90; 94.7902; 90 | 219.19 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241840 | CIF | As2 O3 | P 1 21/n 1 | 4.7371; 11.82822; 4.16968 90; 94.711; 90 | 232.84 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241841 | CIF | As2 O3 | P 1 21/n 1 | 4.6069; 11.5455; 4.04391 90; 94.803; 90 | 214.34 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241842 | CIF | As2 O3 | P 1 21/n 1 | 4.7786; 11.9057; 4.1994 90; 94.695; 90 | 238.11 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241843 | CIF | As2 O3 | P 1 21/n 1 | 5.09945; 12.4945; 4.42425 90; 94.5655; 90 | 280.997 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241844 | CIF | As2 O3 | P 1 21/n 1 | 4.8132; 11.9681; 4.23271 90; 94.6883; 90 | 243.01 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241845 | CIF | As2 O3 | P 1 21/n 1 | 5.269; 12.82716; 4.51254 90; 94.364; 90 | 304.1 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241846 | CIF | As2 O3 | P 1 21/n 1 | 4.9201; 12.15166; 4.3032 90; 94.543; 90 | 256.47 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241847 | CIF | As2 O3 | P 1 21/n 1 | 4.5965; 11.5222; 4.0319 90; 94.769; 90 | 212.8 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241848 | CIF | As2 O3 | P 1 21/n 1 | 4.7416; 11.8243; 4.17264 90; 94.7608; 90 | 233.14 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241849 | CIF | As2 O3 | P 1 21/n 1 | 4.5726; 11.4835; 4.0105 90; 94.821; 90 | 209.84 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241850 | CIF | As2 O3 | P 1 21/n 1 | 4.8178; 11.97404; 4.2306 90; 94.607; 90 | 243.27 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241851 | CIF | As2 O3 | P 1 21/n 1 | 4.6657; 11.67; 4.1027 90; 94.7684; 90 | 222.61 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241852 | CIF | As2 O3 | P 1 21/n 1 | 5.29402; 12.885; 4.50656 90; 94.329; 90 | 306.531 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241853 | CIF | As2 O3 | P 1 21/n 1 | 5.27066; 12.7806; 4.48685 90; 94.579; 90 | 301.28 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241854 | CIF | As2 O3 | P 1 21/n 1 | 5.26373; 12.7447; 4.47691 90; 94.687; 90 | 299.328 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241855 | CIF | As2 O3 | P 1 21/n 1 | 5.29025; 12.8566; 4.502 90; 94.44; 90 | 305.283 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241856 | CIF | As2 O3 | P 1 21/n 1 | 5.28841; 12.8335; 4.50014 90; 94.541; 90 | 304.46 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241857 | CIF | As2 O3 | P 1 21/n 1 | 5.26753; 12.7667; 4.48007 90; 94.738; 90 | 300.251 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241858 | CIF | As2 O3 | P 1 21/n 1 | 5.29393; 12.8775; 4.50545 90; 94.381; 90 | 306.251 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241859 | CIF | As2 O3 | P 1 21/n 1 | 5.27158; 12.7597; 4.48224 90; 94.731; 90 | 300.465 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241860 | CIF | As2 O3 | P 1 21/n 1 | 5.2915; 12.8527; 4.50173 90; 94.533; 90 | 305.205 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241861 | CIF | As2 O3 | P 1 21/n 1 | 5.28379; 12.8173; 4.49485 90; 94.618; 90 | 303.421 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7241862 | CIF | As2 O3 | P 1 21/n 1 | 5.2635; 12.732; 4.46891 90; 94.675; 90 | 298.487 | Guńka, Piotr A.; Hanfland, Michael; Chen, Yu-Sheng; Zachara, Janusz High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph CrystEngComm, 2021, 23, 638-644 |
7231069 | CIF | As4 Na5.35 O182.4 U2 W40 | I -4 | 19.8185; 19.8185; 26.1867 90; 90; 90 | 10285.4 | DUFAYE, Maxime; Duval, Sylvain; Hirsou, Bastien; Stoclet, Grégory; Loiseau, Thierry Complexation of tetravalent uranium cations by the As4W40O140 cryptand CrystEngComm, 2018 |
7239597 | CIF | As6 Ce12 Na18 O341 W58 | P -1 | 18.6179; 19.6067; 27.947 99.61; 105.262; 108.594 | 8970.2 | Dufaye, Maxime; Duval, Sylvain; Stoclet, Gregory; Loiseau, Thierry Influence of pH on CeIV-[AsIIIW9O33]9− association for the formation of hexanuclear cerium(iv) oxo-hydroxo-clusters stabilized by trivacant polyanions CrystEngComm, 2020, 22, 371-380 |
7208333 | CIF | As8 H8 N2 S13 | P b c n | 17.299; 11.951; 23.254 90; 90; 90 | 4808 | Du, Ke-Zhao; Feng, Mei-Ling; Li, Jian-Rong; Huang, Xiao-Ying pH-induced solvothermal synthesis and characterization of two novel thioarsenate compounds: Three-dimensional (1,2-pdaH2)0.5As5S8 containing ψ-As(iii)S4 and two-dimensional (NH4)2As8S13 CrystEngComm, 2012, 14, 4959 |
7211069 | CIF | Au Eu2 Si3 | F m m m | 8.306; 9.0369; 14.377 90; 90; 90 | 1079.1 | Sarkar, Sumanta; Gutmann, Matthias J.; Peter, Sebastian C. Crystal structure and physical properties of indium flux grown RE2AuSi3 (RE = Eu, Yb) CrystEngComm, 2013, 15, 8006 |
7211070 | CIF | Au0.98 Si3.02 Yb2 | F d d d :2 | 8.2003; 14.187; 16.869 90; 90; 90 | 1962.5 | Sarkar, Sumanta; Gutmann, Matthias J.; Peter, Sebastian C. Crystal structure and physical properties of indium flux grown RE2AuSi3 (RE = Eu, Yb) CrystEngComm, 2013, 15, 8006 |
7229623 | CIF | Au11.41 Gd2 Sb3.59 | I 4/m m m | 7.33; 7.33; 14.105 90; 90; 90 | 757.8 | Celania, Chris; Smetana, Volodymyr; Mudring, Anja-Verena Bringing order to large-scale disordered complex metal alloys: Gd2Au15−xSbxand BaAuxGa12−x CrystEngComm, 2018, 20, 348 |
7229624 | CIF | Au11.98 Gd2 Sb3.02 | I 4/m m m | 7.307; 7.307; 14.0497 90; 90; 90 | 750.1 | Celania, Chris; Smetana, Volodymyr; Mudring, Anja-Verena Bringing order to large-scale disordered complex metal alloys: Gd2Au15−xSbxand BaAuxGa12−x CrystEngComm, 2018, 20, 348 |
7229622 | CIF | Au3.56 Ba Ga8.44 | I 4/m c m | 8.771; 8.771; 26.13 90; 90; 90 | 2010 | Celania, Chris; Smetana, Volodymyr; Mudring, Anja-Verena Bringing order to large-scale disordered complex metal alloys: Gd2Au15−xSbxand BaAuxGa12−x CrystEngComm, 2018, 20, 348 |
7229625 | CIF | Au4.38 Ba Ga7.62 | I 4/m c m | 8.774; 8.774; 26.064 90; 90; 90 | 2006.5 | Celania, Chris; Smetana, Volodymyr; Mudring, Anja-Verena Bringing order to large-scale disordered complex metal alloys: Gd2Au15−xSbxand BaAuxGa12−x CrystEngComm, 2018, 20, 348 |
7214638 | CIF | B Be2 F2 K O3 | R -3 c :H | 4.4201; 4.4201; 37.487 90; 90; 120 | 634.27 | Sang, Yuanhua; Yu, Dehong; Avdeev, Maxim; Piltz, Ross; Sharma, Neeraj; Ye, Ning; Liu, Hong; Wang, Jiyang X-ray and neutron diffraction studies of flux and hydrothermally grown nonlinear optical material KBe2BO3F2 CrystEngComm, 2012, 14, 6079 |
7206878 | CIF | B H3 O10 P2 Ti | I 41/a m d :2 | 6.316; 6.316; 16.446 90; 90; 90 | 656.1 | Shi, Hengzhen; Feng, Yuquan; Huang, Qunzeng; Qiu, Dongfang; Li, Min; Liu, Kecheng Ti[BP2O7(OH)3]: The first titanium borophosphate containing novel anionic partial structure CrystEngComm, 2011, 13, 7185 |
7231903 | CIF | B K0.99 O13 Rb2.01 Sb4 | P -1 | 7.1456; 7.239; 13.4113 82.058; 100.051; 117.205 | 606.16 | Doux, Jean-Marie; Stephant, Nicolas; La Salle, Annie Le Gal; Joubert, Olivier; Guyomard, Dominique; Quarez, Eric New KRb2Sb4BO13 and Rb3Sb4BO13 compounds prepared by Rb+/K+ ion exchange from the K3Sb4BO13 ion conductor CrystEngComm, 2019, 21, 594 |
7231901 | CIF | B K3 O13 Sb4 | P -1 | 7.1167; 7.2147; 13.2268 81.973; 99.788; 117.046 | 594.55 | Doux, Jean-Marie; Stephant, Nicolas; La Salle, Annie Le Gal; Joubert, Olivier; Guyomard, Dominique; Quarez, Eric New KRb2Sb4BO13 and Rb3Sb4BO13 compounds prepared by Rb+/K+ ion exchange from the K3Sb4BO13 ion conductor CrystEngComm, 2019, 21, 594 |
7208306 | CIF | B K5 O34 P4 Ta8 | P 1 2/c 1 | 13.8436; 6.4099; 20.5475 90; 125.007; 90 | 1493.44 | Babaryk, Artem A.; Odynets, Ievgen V.; Slobodyanik, Nikolay S.; Baumer, Vyacheslav N.; Khainakov, Sergei Structure-driven mixed-site borate‒phosphate K5Ta8BP4O34: synthesis, structural, spectroscopic and theoretical study CrystEngComm, 2012, 14, 5071 |
7209918 | CIF | B La Mo O6 | P 1 21 1 | 10.2863; 4.1579; 16.339 90; 98.83; 90 | 690.53 | Yu, Yan; Li, Lingyun; Lin, Zhoubin; Wang, Guofu Growth, structure and optical properties of a nonlinear optical crystal α-LaBMoO6 CrystEngComm, 2013, 15, 5245 |
7220280 | CIF | B N O10 Pb6 | P m m n :2 | 5.7534; 9.4518; 11.2735 90; 90; 90 | 613.05 | Song, Jun-Ling; Xu, Xiang; Hu, Chun-Li; Kong, Fang; Mao, Jiang-Gao A facile strategy to adjust the density of planar triangle units in lead borate‒nitrates CrystEngComm, 2015, 17, 3953 |
7231902 | CIF | B O13 Rb3 Sb4 | P -1 | 7.1593; 7.2533; 13.4894 82.358; 99.999; 117.321 | 611.75 | Doux, Jean-Marie; Stephant, Nicolas; La Salle, Annie Le Gal; Joubert, Olivier; Guyomard, Dominique; Quarez, Eric New KRb2Sb4BO13 and Rb3Sb4BO13 compounds prepared by Rb+/K+ ion exchange from the K3Sb4BO13 ion conductor CrystEngComm, 2019, 21, 594 |
7210188 | CIF | B O8 P2 Pb Rb | I -4 2 d | 7.213; 7.213; 13.987 90; 90; 90 | 727.7 | Wang, Ying; Pan, Shilie; Zhang, Min; Han, Shujuan; Su, Xin; Dong, Lingyun Synthesis, crystal growth and characterization of a new noncentrosymmetric borophosphate: RbPbBP2O8 CrystEngComm, 2013, 15, 4956 |
7220059 | CIF | B10 D10 Na2 | P 1 21/c 1 | 6.7137; 13.1237; 11.9402 90; 120.524; 90 | 906.24 | Wu, Hui; Tang, Wan Si; Zhou, Wei; Stavila, Vitalie; Rush, John J.; Udovic, Terrence J. The structure of monoclinic Na2B10H10: a combined diffraction, spectroscopy, and theoretical approach CrystEngComm, 2015, 17, 3533 |
7220060 | CIF | B10 D10 Na2 | P 1 21/c 1 | 6.6535; 12.9636; 11.851 90; 120.203; 90 | 883.42 | Wu, Hui; Tang, Wan Si; Zhou, Wei; Stavila, Vitalie; Rush, John J.; Udovic, Terrence J. The structure of monoclinic Na2B10H10: a combined diffraction, spectroscopy, and theoretical approach CrystEngComm, 2015, 17, 3533 |
7216052 | CIF | B11 Ba2 H7 O22 | P -1 | 6.7745; 6.8452; 21.531 88.152; 82.974; 60.518 | 862.2 | Deng, Ting-Ting; Gao, Yan-E; Zhang, Li-Xia; Gu, Xiang-Yu; Tian, Han-Rui; Liu, Yi; Feng, Yun-Long; Cheng, Jian-Wen Incorporating [GaB4O11(OH)]8− clusters to construct luminescent galloborate with open-framework layers CrystEngComm, 2014, 16, 5689 |
7242010 | CIF | B11 Cs H2 O18 | C 1 2/c 1 | 14.183; 10.192; 11.348 90; 106.022; 90 | 1576.7 | Chen, Zhen; Guo, Jingyu; Han, Shujuan; Zeng, Hao; Yang, Zhihua; Pan, Shilie AB11O16(OH)2 (A = K and Cs): interpenetrating 2D layers with large birefringence CrystEngComm, 2021, 23, 35-39 |
7242009 | CIF | B11 H2 K O18 | C 1 2/c 1 | 14.163; 10.101; 10.664 90; 106.827; 90 | 1460 | Chen, Zhen; Guo, Jingyu; Han, Shujuan; Zeng, Hao; Yang, Zhihua; Pan, Shilie AB11O16(OH)2 (A = K and Cs): interpenetrating 2D layers with large birefringence CrystEngComm, 2021, 23, 35-39 |
7243563 | CIF | B12 Ba H4 O22 Rb2 | P 1 21/c 1 | 9.058; 6.62; 18.294 90; 117.603; 90 | 972.1 | Qiu, Qi-Ming; Sun, Ke-Ning; Yang, Guo-Yu Five new rubidium borates with 0D clusters, 1D chains, 2D layers and 3D frameworks CrystEngComm, 2021, 23, 7081-7089 |
7243363 | CIF | B12 Cs5 H8 Li O25 | P 1 c 1 | 9.3037; 10.863; 13.007 90; 96.316; 90 | 1306.6 | Qiu, Qi-Ming; Yang, Guo-Yu Three mixed-alkaline-metal borates with {Li@B12Ox(OH)24−x} (x = 18, 22) clusters: from isolated oxoboron cluster to unusual layer CrystEngComm, 2021, 23, 6518-6525 |
7243393 | CIF | B12 Cu5.994 Ni0.006 O24 | I -4 2 d | 11.4978; 11.4978; 5.62608 90; 90; 90 | 743.764 | Moshkina, Evgeniya; Molokeev, Maxim; Belskaya, Nadejda; Nemtsev, Ivan; Molchanova, Anastasiia; Boldyrev, Kirill Metastable growth and infrared spectra of CuB2O4:Ni single crystals CrystEngComm, 2021, 23, 6761-6768 |
7243561 | CIF | B12 H12 Na O27 Rb5 | R 3 2 :H | 11.1487; 11.1487; 20.6785 90; 90; 120 | 2225.9 | Qiu, Qi-Ming; Sun, Ke-Ning; Yang, Guo-Yu Five new rubidium borates with 0D clusters, 1D chains, 2D layers and 3D frameworks CrystEngComm, 2021, 23, 7081-7089 |
7243100 | CIF | B12 H13 K O25 | P a -3 | 12.243; 12.243; 12.243 90; 90; 90 | 1835.1 | Qiu, Qi-Ming; Yang, Guo-Yu From [B6O13]8− to [GaB5O13]8− to [Ga{B5O9(OH)}{BO(OH)2}]2−: synthesis, structure and nonlinear optical properties of new metal borates CrystEngComm, 2021, 23, 5200-5207 |
7232237 | CIF | B12 H2 Li2 Na2 O21 | C 1 2/c 1 | 14.259; 13.0995; 10.2027 90; 123.36; 90 | 1591.7 | Han, Bei-Bei; Cheng, Jian-Wen; Yang, Guo-Yu Li2Na2[B12O19(OH)2]: a new open framework borate with a pcu-type net constructed from large cyclic dodeca-oxoboron units CrystEngComm, 2019, 21, 1262 |
7243565 | CIF | B12 H3 Na2 O21 Rb | P a -3 | 12.3596; 12.3596; 12.3596 90; 90; 90 | 1888 | Qiu, Qi-Ming; Sun, Ke-Ning; Yang, Guo-Yu Five new rubidium borates with 0D clusters, 1D chains, 2D layers and 3D frameworks CrystEngComm, 2021, 23, 7081-7089 |
7243562 | CIF | B12 H4 O22 Rb4 | P 1 21/c 1 | 9.154; 6.6585; 18.6325 90; 117.594; 90 | 1006.5 | Qiu, Qi-Ming; Sun, Ke-Ning; Yang, Guo-Yu Five new rubidium borates with 0D clusters, 1D chains, 2D layers and 3D frameworks CrystEngComm, 2021, 23, 7081-7089 |
7208247 | CIF | B15 K6 Li3 O30 Sc2 | R 3 2 :H | 12.7186; 12.7186; 14.914 90; 90; 120 | 2089.3 | Zhao, Sangen; Zhang, Guochun; Yao, Jiyong; Wu, Yicheng K6Li3Sc2B15O30: A new nonlinear optical crystal with a short absorption edge CrystEngComm, 2012, 14, 5209 |
7227703 | CIF | B16 Gd7.5 O48 Sr12 Yb0.5 | P n m a | 7.3859; 15.9445; 8.7003 90; 90; 90 | 1024.59 | Sun, Shijia; Wei, Qi; Lou, Fei; Huang, Yisheng; Yuan, Feifei; Zhang, Lizhen; Lin, Zhoubin A promising ultrafast pulse laser crystal with a disordered structure: Yb3+:Sr3Gd2(BO3)4 CrystEngComm, 2017, 19, 1620 |
7215730 | CIF | B18 H36 K10 O75 V12 | P b c a | 18.212; 19.276; 19.306 90; 90; 90 | 6777.5 | An, Litao; Zhou, Jian; Xiao, Hong-Ping; Liu, Xing; Zou, Huahong; Pan, Chun-Yang; Liu, Meihua; Li, Jianhui A series of new 3-D boratopolyoxovanadates containing five types of [KxOy]n building units CrystEngComm, 2014, 16, 4236 |
7215731 | CIF | B18 H46 K10 O80 V12 | P -1 | 11.901; 13.365; 13.987 117.07; 96.342; 107.344 | 1810 | An, Litao; Zhou, Jian; Xiao, Hong-Ping; Liu, Xing; Zou, Huahong; Pan, Chun-Yang; Liu, Meihua; Li, Jianhui A series of new 3-D boratopolyoxovanadates containing five types of [KxOy]n building units CrystEngComm, 2014, 16, 4236 |
7243343 | CIF | B2 Cu Mn2 Ni3 O10 | P b a m | 9.1735; 12.2939; 3.0018 90; 90; 90 | 338.537 | Moshkina, Evgeniya; Bovina, Asya; Molokeev, Maxim; Krylov, Alexander; Shabanov, Alexander; Chernyshov, Artem; Sofronova, Svetlana Study of flux crystal growth peculiarities, structure and Raman spectra of double (Mn,Ni)3BO5 and triple (Mn,Ni,Cu)3BO5 oxyborates with ludwigite structure CrystEngComm, 2021, 23, 5624-5635 |
7246706 | CIF | B2 Gd Na3 O6 | P 1 21/n 1 | 6.5247; 8.7309; 10.1447 90; 90.8656; 90 | 577.842 | Kuznetsov, Artem B.; Jamous, Ammar Y.; Svetlichnyi, Valery A.; Volkov, Sergey N.; Korolkov, Ilya V.; Kokh, Konstantin A.; Gorelova, Liudmila A.; Krzhizhanovskaya, Maria G.; Aksenov, Sergey M.; Kokh, Alexander E. Growth and characterization of Na3R(BO3)2 (R = La–Gd) borates: crystal structure, high-temperature behavior, and optical properties CrystEngComm, 2023, 25, 2914-2924 |
7220281 | CIF | B2 H N3 O17 Pb6 | C 1 2/c 1 | 12.589; 15.197; 9.669 90; 115.502; 90 | 1669.6 | Song, Jun-Ling; Xu, Xiang; Hu, Chun-Li; Kong, Fang; Mao, Jiang-Gao A facile strategy to adjust the density of planar triangle units in lead borate‒nitrates CrystEngComm, 2015, 17, 3953 |
7220282 | CIF | B2 H N3 O19 Pb8 | P -1 | 9.0637; 9.9713; 11.6123 85.559; 79.021; 88.64 | 1027.14 | Song, Jun-Ling; Xu, Xiang; Hu, Chun-Li; Kong, Fang; Mao, Jiang-Gao A facile strategy to adjust the density of planar triangle units in lead borate‒nitrates CrystEngComm, 2015, 17, 3953 |
7216556 | CIF | B2 K7 O19 P5 | P -1 | 9.9795; 10.1903; 11.6966 91.086; 101.528; 118.691 | 1013.21 | Wang, Ying; Pan, Shilie; Han, Shujuan; Zhang, Bingbing; Dong, Lingyun; Zhang, Min; Yang, Zhihua K7B2P5O19: a novel alkali metal borophosphate with zero dimensional [B2P5O19]7−anionic units CrystEngComm, 2014, 16, 6848 |
7246705 | CIF | B2 Na3 O6 Pr | P 1 21/n 1 | 6.6336; 8.8279; 10.2569 90; 90.9385; 90 | 600.571 | Kuznetsov, Artem B.; Jamous, Ammar Y.; Svetlichnyi, Valery A.; Volkov, Sergey N.; Korolkov, Ilya V.; Kokh, Konstantin A.; Gorelova, Liudmila A.; Krzhizhanovskaya, Maria G.; Aksenov, Sergey M.; Kokh, Alexander E. Growth and characterization of Na3R(BO3)2 (R = La–Gd) borates: crystal structure, high-temperature behavior, and optical properties CrystEngComm, 2023, 25, 2914-2924 |
7224085 | CIF | B2 O6 Rb Sb | C 1 c 1 | 11.7148; 7.1633; 7.4109 90; 125.435; 90 | 506.71 | Yan, Dong; Hu, Chun-Li; Mao, Jiang-Gao A2SbB3O8(A = Na, K, Rb) and β-RbSbB2O6: two types of alkali boroantimonates with 3D anionic architectures composed of SbO6octahedra and borate groups CrystEngComm, 2016, 18, 1655 |
7215727 | CIF | B20 H22 K8 O57 V6 | P 1 21/n 1 | 12.678; 12.682; 15.44 90; 96.706; 90 | 2465 | An, Litao; Zhou, Jian; Xiao, Hong-Ping; Liu, Xing; Zou, Huahong; Pan, Chun-Yang; Liu, Meihua; Li, Jianhui A series of new 3-D boratopolyoxovanadates containing five types of [KxOy]n building units CrystEngComm, 2014, 16, 4236 |
7244188 | CIF | B21 Ca3 H6 Li3 O39 | P 32 2 1 | 8.7306; 8.7306; 12.5809 90; 90; 120 | 830.48 | Chen, Chong-An; Yang, Guo-Yu Syntheses, Structures and Optical Properties of Two B3O7 Cluster-based Borates CrystEngComm, 2022 |
7243364 | CIF | B24 Cs10 H16 Li2 O50 | P 1 21/c 1 | 18.5529; 10.8877; 13.0326 90; 96.274; 90 | 2616.8 | Qiu, Qi-Ming; Yang, Guo-Yu Three mixed-alkaline-metal borates with {Li@B12Ox(OH)24−x} (x = 18, 22) clusters: from isolated oxoboron cluster to unusual layer CrystEngComm, 2021, 23, 6518-6525 |
7243394 | CIF | B24 Cu11.88 Ni0.12 O48 | I -4 2 d | 11.49731; 11.49731; 5.62593 90; 90; 90 | 743.681 | Moshkina, Evgeniya; Molokeev, Maxim; Belskaya, Nadejda; Nemtsev, Ivan; Molchanova, Anastasiia; Boldyrev, Kirill Metastable growth and infrared spectra of CuB2O4:Ni single crystals CrystEngComm, 2021, 23, 6761-6768 |
7218932 | CIF | B3 Be3 F4 Na O9 Sr3 | R 3 m :H | 10.4466; 10.4466; 8.3093 90; 90; 120 | 785.3 | Wang, Xiaoshan; Liu, Lijuan; Wang, Xiaoyang; Bai, Lei; Chen, Chuangtian Growth and optical properties of the novel nonlinear optical crystal NaSr3Be3B3O9F4 CrystEngComm, 2015, 17, 925 |
7214428 | CIF | B3 Be4 K O9 | P 1 2/c 1 | 6.065; 4.463; 11.55 90; 90.081; 90 | 312.6 | Wang, Shichao; Ye, Ning; Zou, Guohong A new alkaline beryllium borate KBe4B3O9 with ribbon alveolate [Be2BO5]∞layers and the structural evolution of ABe4B3O9(A = K, Rb and Cs) CrystEngComm, 2014, 16, 3971 |
7243483 | CIF | B3 Ca4 Ho O10 | C 1 m 1 | 8.09; 16.018; 3.5317 90; 101.284; 90 | 448.8 | Yu, Pingzhang; Pan, Xiaobo; Wu, Guangda; Liu, Yanqing; Yu, Fapeng; Wang, Zhengping; Xu, Xinguang Crystal growth, optical, thermal and piezoelectric properties of HoCa4O(BO3)3 crystal CrystEngComm, 2021, 23, 6574-6581 |
7209847 | CIF | B3 Ca4 O10 Pr | C 1 m 1 | 8.1772; 16.157; 3.6286 90; 101.399; 90 | 469.95 | Yu, Fapeng; Zhang, Shujun; Cheng, Xiufeng; Duan, Xiulan; Ma, Tingfeng; Zhao, Xian Crystal growth, structure and thermal properties of noncentrosymmetric single crystals PrCa4O(BO3)3 CrystEngComm, 2013, 15, 5226 |
7216216 | CIF | B3 Ca4 O10 Tm | C 1 m 1 | 8.0679; 16.014; 3.5224 90; 101.112; 90 | 446.56 | Liu, Yanqing; Yu, Fapeng; Wang, Zhengping; Hou, Shuai; Yang, Lei; Xu, Xinguang; Zhao, Xian Bulk growth and nonlinear optical properties of thulium calcium oxyborate single crystals CrystEngComm, 2014, 16, 7141 |
7214380 | CIF | B3 Ca4.01 O10 Tb0.99 | C 1 m 1 | 8.0715; 16; 3.5454 90; 101.255; 90 | 449.06 | Yuan, Dongsheng; Jia, Zhitai; Wang, Jian; Gao, Zeliang; Zhang, Junjie; Fu, Xiuwei; Shu, Jun; Yin, Yanru; Hu, Qiangqiang; Tao, Xutang Bulk growth, structure, and characterization of the new monoclinic TbCa4O(BO3)3 crystal CrystEngComm, 2014, 16, 4008 |
7225838 | CIF | B3 Ca4.03 La0.11 O10 Y0.86 | C 1 m 1 | 8.1214; 16.1024; 3.5623 90; 101.211; 90 | 456.97 | Qi, Hongwei; Wang, Fang; Chai, Xiangxu; Wang, Zhengping; Yu, Fapeng; Liu, Yanqing; Zhao, Xian; Xu, Xinguang Growth and non-critical phase-matching frequency conversion properties of LaxY1−xCOB crystals CrystEngComm, 2016, 18, 6205 |
7244570 | CIF | B3 Cd4 Eu O10 | C 1 m 1 | 7.9673; 15.7619; 3.4932 90; 100.186; 90 | 431.76 | Cao, Ming-Yang; Hu, Chun-Li; Chen, Peng-Fei; Wang, Qian; Li, Bing-Xuan; Lin, Yuan; Mao, Jiang-Gao Cd4REO(BO3)3 (RE = Sm, Eu, Tb): three new cadmium–rare earth oxyborates with both good NLO and luminescence properties CrystEngComm, 2022 |
7244568 | CIF | B3 Cd4 O10 Sm | C 1 m 1 | 7.9798; 15.7654; 3.5051 90; 100.208; 90 | 433.98 | Cao, Ming-Yang; Hu, Chun-Li; Chen, Peng-Fei; Wang, Qian; Li, Bing-Xuan; Lin, Yuan; Mao, Jiang-Gao Cd4REO(BO3)3 (RE = Sm, Eu, Tb): three new cadmium–rare earth oxyborates with both good NLO and luminescence properties CrystEngComm, 2022 |
7244569 | CIF | B3 Cd4 O10 Tb | C 1 m 1 | 7.9549; 15.7709; 3.4813 90; 100.227; 90 | 429.81 | Cao, Ming-Yang; Hu, Chun-Li; Chen, Peng-Fei; Wang, Qian; Li, Bing-Xuan; Lin, Yuan; Mao, Jiang-Gao Cd4REO(BO3)3 (RE = Sm, Eu, Tb): three new cadmium–rare earth oxyborates with both good NLO and luminescence properties CrystEngComm, 2022 |
7209604 | CIF | B3 Cd5 F O9 | C 1 m 1 | 8.057; 15.966; 3.447 90; 100.06; 90 | 436.6 | Zou, Guohong; Zhang, Liyuan; Ye, Ning Synthesis, structure, and characterization of a new promising nonlinear optical crystal: Cd5(BO3)3F CrystEngComm, 2013, 15, 2422 |
7224083 | CIF | B3 K2 O8 Sb | P 1 21/c 1 | 5.9013; 11.0876; 10.9497 90; 103.218; 90 | 697.47 | Yan, Dong; Hu, Chun-Li; Mao, Jiang-Gao A2SbB3O8(A = Na, K, Rb) and β-RbSbB2O6: two types of alkali boroantimonates with 3D anionic architectures composed of SbO6octahedra and borate groups CrystEngComm, 2016, 18, 1655 |
7224082 | CIF | B3 Na2 O8 Sb | P 1 21/c 1 | 5.8278; 10.3521; 10.4775 90; 102.948; 90 | 616.04 | Yan, Dong; Hu, Chun-Li; Mao, Jiang-Gao A2SbB3O8(A = Na, K, Rb) and β-RbSbB2O6: two types of alkali boroantimonates with 3D anionic architectures composed of SbO6octahedra and borate groups CrystEngComm, 2016, 18, 1655 |
7224084 | CIF | B3 O8 Rb2 Sb | P 1 21/c 1 | 5.9381; 11.2928; 11.3181 90; 103.754; 90 | 737.2 | Yan, Dong; Hu, Chun-Li; Mao, Jiang-Gao A2SbB3O8(A = Na, K, Rb) and β-RbSbB2O6: two types of alkali boroantimonates with 3D anionic architectures composed of SbO6octahedra and borate groups CrystEngComm, 2016, 18, 1655 |
7229595 | CIF | B3.51 Ba7 F3.47 O10.53 | P 63 | 11.18241; 11.18241; 7.2372 90; 90; 120 | 783.74 | Bekker, T. B.; Rashchenko, S. V.; Bakakin, V. V.; Seryotkin, Yu. V.; Fedorov, P. P.; Kokh, A. E.; Stonoga, S. Yu. Phase formation in the BaB2O4‒BaF2‒BaO system and new non-centrosymmetric solid-solution series Ba7(BO3)4−xF2+3x CrystEngComm, 2012, 14, 6910 |
7208304 | CIF | B36 H61 Na18 O144 V24 Zn | C 1 2/c 1 | 19.348; 21.786; 16.051 90; 91.82; 90 | 6762 | Hermosilla-Ibáñez, Patricio; Car, Pierre Emmanuel; Vega, Andrés; Costamagna, Juan; Caruso, Francesco; Pivan, Jean-Yves; Fur, Eric Le; Spodine, Evgenia; Venegas-Yazigi, Diego New structures based on the mixed valence polyoxometalate cluster [V12B18O60H6]n− CrystEngComm, 2012, 14, 5604 |
7216053 | CIF | B4 Ba Ga H3 O10 | P -1 | 7.108; 7.1372; 9.878 106.885; 91.569; 119.185 | 409.99 | Deng, Ting-Ting; Gao, Yan-E; Zhang, Li-Xia; Gu, Xiang-Yu; Tian, Han-Rui; Liu, Yi; Feng, Yun-Long; Cheng, Jian-Wen Incorporating [GaB4O11(OH)]8− clusters to construct luminescent galloborate with open-framework layers CrystEngComm, 2014, 16, 5689 |
7248397 | CIF | B4 Co1.76 Ni4.24 O12 | P n n m | 4.4917; 5.4314; 8.3789 90; 90; 90 | 204.41 | Sofronova, Svetlana; Moshkina, Evgeniya; Chernyshev, Artem; Vasil’ev, Alexander D.; Maximov, Nikolai; Aleksandrovsky, A.S.; Andryushchenko, Tatyana; Shabanov, Alexander Crystal growth and cation order of Ni3-xCoxB2O6 oxyborates CrystEngComm, 2024 |
7243341 | CIF | B4 Cu Mn4 Ni7 O20 | P b a m | 9.19375; 12.33041; 3.016669 90; 90; 90 | 341.978 | Moshkina, Evgeniya; Bovina, Asya; Molokeev, Maxim; Krylov, Alexander; Shabanov, Alexander; Chernyshov, Artem; Sofronova, Svetlana Study of flux crystal growth peculiarities, structure and Raman spectra of double (Mn,Ni)3BO5 and triple (Mn,Ni,Cu)3BO5 oxyborates with ludwigite structure CrystEngComm, 2021, 23, 5624-5635 |
7243342 | CIF | B4 Cu Mn4 Ni7 O20 | P b a m | 9.1828; 12.2766; 3.0091 90; 90; 90 | 339.227 | Moshkina, Evgeniya; Bovina, Asya; Molokeev, Maxim; Krylov, Alexander; Shabanov, Alexander; Chernyshov, Artem; Sofronova, Svetlana Study of flux crystal growth peculiarities, structure and Raman spectra of double (Mn,Ni)3BO5 and triple (Mn,Ni,Cu)3BO5 oxyborates with ludwigite structure CrystEngComm, 2021, 23, 5624-5635 |
7228083 | CIF | B4 H11.25 K2 O12.63 | P b c n | 11.15; 13.064; 16.411 90; 90; 90 | 2390.5 | Sambasivam, Sangaraju; Liu, Lili; Yang, Yun; Han, Guopeng; Bashir, Beenish; Yang, Zhihua; Pan, ShiLie Syntheses, Crystal Structures and Characterizations of Three Alkaline Metal Borates CrystEngComm, 2017 |
7245559 | CIF | B4 H16 N2 O11 | P 1 21 1 | 7.16499; 10.59066; 7.24742 90; 98.629; 90 | 543.723 | Vaz, Raphael C. A.; Esteves, Isabela O.; Oliveira, Willian X. C.; Honorato, João; Martins, Felipe T.; da Silva Júnior, Eufrânio N.; de C. A. Valente, Daniel; Cardozo, Thiago M.; Horta, Bruno A. C.; Mariano, Davor L.; Nunes, Wallace C.; Pedroso, Emerson F.; Pereira, Cynthia L. M. Lanthanide(iii)-oxamato complexes containing Nd3+ and Ho3+: crystal structures, magnetic properties, and ab initio calculations CrystEngComm, 2022 |
7245560 | CIF | B4 H16 N2 O11 | P 1 21 1 | 7.16499; 10.59066; 7.24742 90; 98.629; 90 | 543.723 | Vaz, Raphael C. A.; Esteves, Isabela O.; Oliveira, Willian X. C.; Honorato, João; Martins, Felipe T.; da Silva Júnior, Eufrânio N.; de C. A. Valente, Daniel; Cardozo, Thiago M.; Horta, Bruno A. C.; Mariano, Davor L.; Nunes, Wallace C.; Pedroso, Emerson F.; Pereira, Cynthia L. M. Lanthanide(iii)-oxamato complexes containing Nd3+ and Ho3+: crystal structures, magnetic properties, and ab initio calculations CrystEngComm, 2022 |
7228082 | CIF | B4 H6 K2 O10 | P -1 | 7.1742; 7.8472; 8.9702 68.551; 88.368; 74.877 | 452.49 | Sambasivam, Sangaraju; Liu, Lili; Yang, Yun; Han, Guopeng; Bashir, Beenish; Yang, Zhihua; Pan, ShiLie Syntheses, Crystal Structures and Characterizations of Three Alkaline Metal Borates CrystEngComm, 2017 |
7215134 | CIF | B45 K21 O90 Yb8 | R 3 2 :H | 13.2068; 13.2068; 14.76 90; 90; 120 | 2229.5 | Feng, Kai; Yin, Wenlong; Hao, Wenyu; Yao, Jiyong; Wu, Yicheng A novel UV nonlinear optical crystal material: K21Yb8B45O90 CrystEngComm, 2013, 15, 5064 |
7213712 | CIF | B5 Cs2 Li3 O10 | C 2 2 21 | 7.2256; 11.6583; 12.7817 90; 90; 90 | 1076.71 | Yang, Yun; Su, Xin; Pan, Shilie; Zhang, Min; Wang, Ying; Han, Jian; Yang, Zhihua Crystal growth and calculation of the electronic band structure and density of states of Li3Cs2B5O10 CrystEngComm, 2014, 16, 1978 |
7216554 | CIF | B5 Eu O10 Zn | P 1 21/n 1 | 8.6173; 7.5994; 9.4036 90; 93.358; 90 | 614.75 | Hao, Yu-Cheng; Xu, Xiang; Kong, Fang; Song, Jun-Ling; Mao, Jiang-Gao PbCd2B6O12and EuZnB5O10: syntheses, crystal structures and characterizations of two new mixed metal borates CrystEngComm, 2014, 16, 7689 |
7243564 | CIF | B5 H O9 Rb2 | P c a 21 | 8.5942; 7.6284; 13.1321 90; 90; 90 | 860.94 | Qiu, Qi-Ming; Sun, Ke-Ning; Yang, Guo-Yu Five new rubidium borates with 0D clusters, 1D chains, 2D layers and 3D frameworks CrystEngComm, 2021, 23, 7081-7089 |
7208231 | CIF | B6 Ba2 Mg O12 | R -3 :H | 7.094; 7.094; 16.721 90; 90; 120 | 728.7 | Li, R. K.; Ma, Yingying Chemical engineering of a birefringent crystal transparent in the deep UV range CrystEngComm, 2012, 14, 5421 |
7205749 | CIF | B6 Br K3 O10 | R 3 m :H | 10.1153; 10.1153; 8.8592 90; 90; 120 | 785.02 | Zhang, Min; Pan, Shi-Lie; Fan, Xiao-Yun; Zhou, Zhong-Xiang; Poeppelmeier, Kenneth R.; Yang, Yun Crystal growth and optical properties of a noncentrosymmetric haloid borate, K3B6O10Br CrystEngComm, 2011, 13, 2899 |
7225837 | CIF | B6 Ca8 La0.18 O20 Y1.81 | C 1 m 1 | 8.0806; 16.0141; 3.5431 90; 101.206; 90 | 449.75 | Qi, Hongwei; Wang, Fang; Chai, Xiangxu; Wang, Zhengping; Yu, Fapeng; Liu, Yanqing; Zhao, Xian; Xu, Xinguang Growth and non-critical phase-matching frequency conversion properties of LaxY1−xCOB crystals CrystEngComm, 2016, 18, 6205 |
7216553 | CIF | B6 Cd2 O12 Pb | P 1 21/n 1 | 6.557; 6.9924; 19.2094 90; 90.285; 90 | 880.72 | Hao, Yu-Cheng; Xu, Xiang; Kong, Fang; Song, Jun-Ling; Mao, Jiang-Gao PbCd2B6O12and EuZnB5O10: syntheses, crystal structures and characterizations of two new mixed metal borates CrystEngComm, 2014, 16, 7689 |
7209289 | CIF | B6 Cl2 H10 Na13 O47 P11 | F 2 3 | 20.479; 20.479; 20.479 90; 90; 90 | 8589 | Feng, Yuquan; Li, Min; Shi, Hengzhen; Huang, Qunzeng; Qiu, Dongfang A novel chlorine-containing borophosphate based on (4,3)-connected 3-D borophosphate anion [B6P11O42(OH)2]13− with unique B : P ratio and 22-tetrahedral cages CrystEngComm, 2013, 15, 2048 |
7243101 | CIF | B6 Cs Ga H3 Na O13 | P -1 | 7.027; 8.039; 11.442 108.567; 93.633; 90.442 | 611.2 | Qiu, Qi-Ming; Yang, Guo-Yu From [B6O13]8− to [GaB5O13]8− to [Ga{B5O9(OH)}{BO(OH)2}]2−: synthesis, structure and nonlinear optical properties of new metal borates CrystEngComm, 2021, 23, 5200-5207 |
7244953 | CIF | B6 I Na3 O10 | P n m a | 12.8162; 9.9063; 7.6762 90; 90; 90 | 974.58 | Volkov, Sergey; Charkin, Dmitri O.; Arsentev, Maxim; Aksenov, Sergey; Manelis, Lev; Krzhizhanovskaya, Maria; Sinelshikova, Olga; Ugolkov, Valeriy Leonidovich; Povolotskiy, Alexey; Shilovskikh, Vladimir; Antonov, Andrey; Bubnova, Rimma Where the extraordinaries meet: a cascade of isosymmetrical superionic phase transitions and negative thermal expansion in a novel silver salt-inclusion borate halide CrystEngComm, 2022 |
7243488 | CIF | B7 Ba12 F4 Li O21 | P 42/m b c | 13.5174; 13.5174; 14.9399 90; 90; 90 | 2729.82 | Bekker, T. B.; Yelisseyev, A. P.; Solntsev, V. P.; Davydov, A. V.; Inerbaev, T. M.; Rashchenko, S. V.; Kostyukov, A. I. The influence of co-doping on the luminescence and thermoluminescence properties of Cu-containing fluoride borate crystals CrystEngComm, 2021, 23, 6599-6609 |
7245757 | CIF | B7 Cs Ga H4 K Na O15.5 | P 1 21/n 1 | 11.5142; 7.0317; 17.2789 90; 92.127; 90 | 1398 | Dong, Ya-Zhuo; Chen, Chong-An; Chen, Juan; Cheng, Jian-Wen; Li, Jinhua; Yang, Guo-Yu Two porous-layered borates built by B7O13(OH) clusters and AlO4/GaO4 tetrahedra CrystEngComm, 2022 |
7228081 | CIF | B7 Cs2 H5 O14 | P 1 21/n 1 | 8.356; 11.971; 14.109 90; 103.52; 90 | 1372 | Sambasivam, Sangaraju; Liu, Lili; Yang, Yun; Han, Guopeng; Bashir, Beenish; Yang, Zhihua; Pan, ShiLie Syntheses, Crystal Structures and Characterizations of Three Alkaline Metal Borates CrystEngComm, 2017 |
7208643 | CIF | B7 Li5 O14 Rb2 | A m a 2 | 20.376; 13.5114; 4.39 90; 90; 90 | 1208.6 | Yang, Yun; Pan, Shilie; Hou, Xueling; Dong, Xiaoyu; Su, Xin; Yang, Zhihua; Zhang, Min; Zhao, Wenwu; Chen, Zhaohui Li5Rb2B7O14: a new congruently melting compound with two kinds of B‒O one-dimensional chains and short UV absorption edge CrystEngComm, 2012, 14, 6720 |
7208302 | CIF | B72 H181 Na32 Ni4 O314 V48 | C 1 2/c 1 | 19.3555; 21.7874; 16.0415 90; 92.452; 90 | 6758.6 | Hermosilla-Ibáñez, Patricio; Car, Pierre Emmanuel; Vega, Andrés; Costamagna, Juan; Caruso, Francesco; Pivan, Jean-Yves; Fur, Eric Le; Spodine, Evgenia; Venegas-Yazigi, Diego New structures based on the mixed valence polyoxometalate cluster [V12B18O60H6]n− CrystEngComm, 2012, 14, 5604 |
7210685 | CIF | B8 Cd7 Na2 O20 | F d d 2 | 51.5597; 58.692; 3.381 90; 90; 90 | 10231.4 | Zhou, Lin; Pan, Shilie; Dong, Xiaoyu; Yu, Hongwei; Wu, Hongping; Zhang, Fangfang; Zhou, Zhongxiang Na2Cd7B8O20: a new noncentrosymmetric compound with special [B3O7] units CrystEngComm, 2013, 15, 3412 |
7244078 | CIF | B9 Cd3 H3 K Na5 O38 P6 | P 63/m | 12.071; 12.071; 12.118 90; 90; 120 | 1529.1 | Feng, Yuquan; Lv, Linxia; Bi, Dongqin; Zhong, Zhiguo; Li, Jing; Yue, Zilong; Zeng, Zhaoge; Zhang, Shuhan; Meng, Zhaohui Efficient degradation of reactive brilliant red on the first open-framework borate-rich cadmium borophosphate CrystEngComm, 2022, 24, 479-483 |
7205868 | CIF | Ba Gd K Mo3 O12 | C 1 2/c 1 | 17.401; 12.226; 5.324 90; 106.19; 90 | 1087.7 | Meng, Xiangming; Lin, Zhoubin; Zhang, Lizhen; Huang, Yisheng; Wang, Guofu Structure and spectral properties of Nd3±doped KBaGd(MoO4)3 crystal with a disorder structure CrystEngComm, 2011, 13, 4069 |
7245327 | CIF | Ba H8 O14 P2 V2 | P 1 n 1 | 6.3867; 12.7855; 6.3889 90; 90.165; 90 | 521.7 | Wang, Xinmei; Qi, Lu; Wu, Lei; Zhang, Ruixin; Abudoureheman, Maierhaba; Lv, Jiarong; Wang, Peng; Dong, Xiaoyu; Jing, Qun; Chen, Zhaohui Synergistic effect of 2[V2P2O14]∞ layers and hydrogen bonds inducing large birefringence in M(VO)2(PO4)2·4H2O (M = Ca, Sr, Ba) system CrystEngComm, 2022 |
7230694 | CIF | Ba K Lu Mo3 O12 | C 1 2/c 1 | 17.346; 12.1461; 5.2406 90; 105.236; 90 | 1065.31 | Wang, G. Q.; Li, L. Y.; Feng, Y. N.; Yu, H.; Zheng, X. H. Tb3± and Yb3±doped novel KBaLu(MoO4)3 crystals with disordered chained structure showing down- and up-conversion luminescence CrystEngComm, 2018, 20, 3657 |
7216467 | CIF | Ba O6 Pb Si2 | C m c m | 5.5092; 15.45; 7.287 90; 90; 90 | 620.2 | Dong, Lingyun; Pan, Shilie; Wang, Ying; Yu, Hongwei; Bian, Qiang; Yang, Zhihua; Wu, Hongping; Zhang, Min BaPbSi2O6·BaSO4: the first mixed anionic compound synthesized via BaSO4 salt-inclusion CrystEngComm, 2014 |
7211346 | CIF | Ba O9 Te W2 | P n m a | 13.9824; 5.5774; 9.8671 90; 90; 90 | 769.49 | Zhang, Zhonghan; Tao, Xutang; Zhang, Junjie; Sun, Youxuan; Zhang, Chengqian; Li, Bo Synthesis, crystal growth, and characterization of the orthorhombic BaTeW2O9: a new polymorph of BaTeW2O9 CrystEngComm, 2013, 15, 10197 |
1540392 | CIF | Ba0.1 O4 Si Sr1.9 | P m n b | 5.674; 7.086; 9.745 90; 90; 90 | 391.81 | Li, Xiaojun; Hua, Youjie; Ma, Hongping; Deng, Degang; Xu, Shiqing Modification of the crystal structure of Sr2−xBaxSi(O,N)4: Eu2+phosphors to improve their luminescence properties CrystEngComm, 2015, 17, 9123 |
1540393 | CIF | Ba0.15 N O4 Si Sr2.85 | P m n b | 5.6796; 7.1386; 9.7639 90; 90; 90 | 395.87 | Li, Xiaojun; Hua, Youjie; Ma, Hongping; Deng, Degang; Xu, Shiqing Modification of the crystal structure of Sr2−xBaxSi(O,N)4: Eu2+phosphors to improve their luminescence properties CrystEngComm, 2015, 17, 9123 |
7234925 | CIF | Ba0.5 Ga0.33 I2 O6 | R -3 :H | 11.2465; 11.2465; 11.2217 90; 90; 120 | 1229.2 | Xiao, Lei; You, Fengguang; Gong, Pifu; Hu, Zhanggui; Lin, Zheshuai Synthesis and structure of a new mixed metal iodate Ba3Ga2(IO3)12 CrystEngComm, 2019, 21, 4981 |
7214224 | CIF | Ba18 F18 In8 S21 | P 42/n c m :2 | 22.0703; 22.0703; 12.6143 90; 90; 90 | 6144.4 | Luo, Zhong-Zhen; Lin, Chen-Sheng; Zhang, Wei-Long; Zhang, Hao; He, Zhang-Zhen; Cheng, Wen-Dan Ba18F18In8S21 and Ba9F10In4S10: new kind of mixed anion compounds with the novel low-dimensional structure CrystEngComm, 2014, 16, 2788 |
7229267 | CIF | Ba2 Cd2 O12 Se4 | P n m a | 16.5983; 5.4518; 7.1154 90; 90; 90 | 643.88 | Jia, Ying-Jie; Chen, Yi-Gang; Yao, Xiao-Ni; Zhang, Xian-Ming Alkali Earth MOx (x=6, 7, 9, 12) Polyhedra Tuned Cadmium Selenites with Different Dimensions and Diverse SeO32-Coordinations CrystEngComm, 2017 |
7208002 | CIF | Ba2 La3 Li3 O32 W8 | C 1 2/c 1 | 5.323; 13.091; 19.48 90; 91.18; 90 | 1357 | Pan, Yu; Chen, Yujin; Lin, Yanfu; Gong, Xinghong; Huang, Jianhua; Luo, Zundu; Huang, Yidong Structure, spectral properties and laser performance of Tm3±doped Li3Ba2La3(WO4)8 crystal CrystEngComm, 2012, 14, 3930 |
7208856 | CIF | Ba2 Li3 Mo8 O32 Y3 | C 1 2/c 1 | 5.2052; 12.6763; 19.107 90; 91.293; 90 | 1260.4 | Song, Mingjun; Zhou, Weiwei; Wu, Mingyan; Wang, Guofu Structure, thermal and spectroscopic properties of Tm3±doped Li3Ba2Y3(MoO4)8 crystal as a promising candidate for 2 μm lasers CrystEngComm, 2013, 15, 168 |
7211787 | CIF | Ba2 Li3 O32 W8 Y3 | C 1 2/c 1 | 5.181; 12.677; 19.161 90; 92.237; 90 | 1257.5 | Li, Hao; Wang, Guojian; Zhang, Lizhen; Huang, Yisheng; Wang, Guofu Growth and structure of Nd3±doped Li3Ba2Y3(WO4)8 crystal with a disorder structure CrystEngComm, 2010, 12, 1307 |
7248137 | CIF | Ba2 Mn S3 | P n m a | 8.8896; 4.3363; 17.221 90; 90; 90 | 663.835 | Moore, Benjamin J.; Cui, Z. X.; Liu, Y.; Gutmann, Matthias J.; Teather, E. N.; Orlandi, Fabio; Balz, Christian; Manuel, Pascal; Perry, R. S. Crystal growth of ternary metal sulfides from an open melt: Ba2MnS3 CrystEngComm, 2024, 26, 1444-1452 |
7248138 | CIF | Ba2 Mn S3 | P n m a | 8.824; 4.3415; 17.1357 90; 90; 90 | 656.458 | Moore, Benjamin J.; Cui, Z. X.; Liu, Y.; Gutmann, Matthias J.; Teather, E. N.; Orlandi, Fabio; Balz, Christian; Manuel, Pascal; Perry, R. S. Crystal growth of ternary metal sulfides from an open melt: Ba2MnS3 CrystEngComm, 2024, 26, 1444-1452 |
7216468 | CIF | Ba2 O10 Pb S Si2 | P n m a | 7.252; 5.4841; 24.352 90; 90; 90 | 968.5 | Dong, Lingyun; Pan, Shilie; Wang, Ying; Yu, Hongwei; Bian, Qiang; Yang, Zhihua; Wu, Hongping; Zhang, Min BaPbSi2O6·BaSO4: the first mixed anionic compound synthesized via BaSO4 salt-inclusion CrystEngComm, 2014 |
7210711 | CIF | Ba3 Ga2 H6 O18 P6 | R -3 :H | 15.7158; 15.7158; 12.679 90; 90; 120 | 2712 | Wang, Xi-Jia; Zhang, Jian-Han; Song, Jun-Ling; Kong, Fang; Mao, Jiang-Gao Syntheses, crystal structures of a series of novel alkali metal or alkaline earth metal phosphites CrystEngComm, 2013, 15, 2519 |
7210712 | CIF | Ba3 H6 In2 O18 P6 | R -3 :H | 15.932; 15.932; 13.327 90; 90; 120 | 2930 | Wang, Xi-Jia; Zhang, Jian-Han; Song, Jun-Ling; Kong, Fang; Mao, Jiang-Gao Syntheses, crystal structures of a series of novel alkali metal or alkaline earth metal phosphites CrystEngComm, 2013, 15, 2519 |
7215189 | CIF | Ba4 H61 Na2 O71.5 W12 | P 1 21/c 1 | 11.4467; 23.8573; 12.462 90; 110.458; 90 | 3188.6 | Cui, Keyu; Li, Fengyan; Xu, Lin; Wang, Yuchao; Sun, Zhixia; Fu, Honggang A 3D all-inorganic architecture based on the [H2W12O42]10− building block with different alkaline-earth metal linkers: crystal structures, surface photovoltage and photoluminescent properties CrystEngComm, 2013, 15, 4721 |
7214225 | CIF | Ba9 F10 In4 S10 | P n m a | 12.5686; 19.2822; 12.5835 90; 90; 90 | 3049.6 | Luo, Zhong-Zhen; Lin, Chen-Sheng; Zhang, Wei-Long; Zhang, Hao; He, Zhang-Zhen; Cheng, Wen-Dan Ba18F18In8S21 and Ba9F10In4S10: new kind of mixed anion compounds with the novel low-dimensional structure CrystEngComm, 2014, 16, 2788 |
7241191 | CIF | Bi F3 H2 O | P 63/m | 6.1202; 6.1202; 3.6957 90; 90; 120 | 119.883 | Liu, Xian; Yang, Can; Wu, Qi; Sun, Juan; Liang, Fei From BiF3 to BiF3·H2O: Diverse Bi(Ⅲ) Coordination for Structural Transformation and Birefringence Regulation CrystEngComm, 2020 |
7218127 | CIF | Bi Ge N O7 | P b c a | 11.4551; 4.95346; 18.1676 90; 90; 90 | 1030.87 | Kobayashi, Kiyoshi; Ikeda, Takuji; Hiyoshi, Norihito; Sakka, Yoshio Discovery of a new crystalline phase: BiGeO2(OH)2(NO3) CrystEngComm, 2014, 16, 10080 |
7223784 | CIF | Bi0.55 Mo O4 | I 41/a | 5.239; 5.239; 11.567 90; 90; 90 | 317.5 | Zhang, Yang; Cong, Hengjiang; Ji, Nianjing; Liu, Jian; Duan, Xiulan; Li, Jing; Cao, Wenwu; Wang, Jiyang; Jiang, Huaidong Effect of high bismuth deficiency on structure and oxide ion conductivity of a Bi0.55MoO4single crystal CrystEngComm, 2015, 17, 8746 |
7200733 | CIF | Bi2 H62 Na5 O107 Pd4.5 W22 | P -1 | 12.8207; 13.1305; 17.407 108.61; 98.928; 109.55 | 2501.9 | Bi, Li-Hua; Dickman, Michael H.; Kortz, Ulrich The palladium(II)-decorated 22-tungsto-2-bismuthate(III), [Pd3(H2O)9Bi2W22O76]8− CrystEngComm, 2009, 11, 965 |
7208748 | CIF | Bi2 La0.5 Na0.5 Nb1.972 O9 W0.023 | A 21 a m | 5.48754; 5.47967; 24.8523 90; 90; 90 | 747.31 | Long, Changbai; Fan, Huiqing; Li, Mengmeng; Li, Qiang Effect of lanthanum and tungsten co-substitution on the structure and properties of new Aurivillius oxides Na0.5La0.5Bi2Nb2-xWxO9 CrystEngComm, 2012, 14, 7201 |
7208747 | CIF | Bi2 La0.5 Na0.5 Nb2 O9 | A 21 a m | 5.49254; 5.47896; 24.8632 90; 90; 90 | 748.22 | Long, Changbai; Fan, Huiqing; Li, Mengmeng; Li, Qiang Effect of lanthanum and tungsten co-substitution on the structure and properties of new Aurivillius oxides Na0.5La0.5Bi2Nb2-xWxO9 CrystEngComm, 2012, 14, 7201 |
7210230 | CIF | Bi2 Mn Te4 | R -3 m :H | 4.3337; 4.3337; 40.9103 90; 90; 120 | 665.4 | Lee, Dong Sun; Kim, Tae-Hoon; Park, Cheol-Hee; Chung, Chan-Yeup; Lim, Young Soo; Seo, Won-Seon; Park, Hyung-Ho Crystal structure, properties and nanostructuring of a new layered chalcogenide semiconductor, Bi2MnTe4 CrystEngComm, 2013, 15, 5532 |
7220303 | CIF | Bi2 Mo2.66 O12 W0.34 | P 1 21/c 1 | 7.7212; 11.4938; 11.997 90; 115.507; 90 | 960.91 | Tian, Xiangxin; Wu, Qian; Zhao, Peng; Wang, Zheng; Feng, Xiaoxiao; Li, Conggang; Sun, Youxuan; Wang, Shanpeng; Gao, Zeliang; Tao, Xutang Top-seeded solution growth and characterization of a Bi2Mo2.66W0.34O12single crystal CrystEngComm, 2015, 17, 4525 |
7223785 | CIF | Bi2 Mo3 O12 | P 1 21/n 1 | 7.715; 11.5101; 11.1237 90; 103.364; 90 | 961.04 | Zhang, Yang; Cong, Hengjiang; Ji, Nianjing; Liu, Jian; Duan, Xiulan; Li, Jing; Cao, Wenwu; Wang, Jiyang; Jiang, Huaidong Effect of high bismuth deficiency on structure and oxide ion conductivity of a Bi0.55MoO4single crystal CrystEngComm, 2015, 17, 8746 |
7243110 | CIF | Bi2 Ni2 O10 P2 | P -1 | 7.4211; 6.5606; 5.1633 83.817; 110.727; 123.412 | 195.03 | Colmont, Marie; Zadoya, Anastasiya; Darie, Céline; Domingos, Cyril; Leclercq, Bastien; Mentré, Olivier Direct Bi3±-Bi3+ contacts mediated by lone pairs in the HP-BiNiO(PO4) polymorph CrystEngComm, 2021, 23, 5124-5130 |
7230340 | CIF | Bi2 O9 W2 | P b c n | 23.705; 5.4148; 5.4345 90; 90; 90 | 697.56 | Tian, Xiangxin; Gao, Zeliang; Chen, Feifei; Wu, Qian; Li, Conggang; Lu, Weiqun; Sun, Youxuan; Tao, Xutang Insights into the polymorphism of Bi2W2O9: single crystal growth and a complete survey of the variable-temperature thermal and dielectric properties CrystEngComm, 2018, 20, 2669 |
7200897 | CIF | Bi2.5 F0.1 H0.9 Na2.5 O12.9 P3 | P 63 | 9.5049; 9.5049; 6.9484 90; 90; 120 | 543.64 | Zhou, Yan; Huang, Ya-Xi; Pan, Yuanming; Mi, Jin-Xiao Single-crystal microtubes of a novel apatite-type compound, (Na2.5Bi2.5)(PO4)3(F,OH), with well-faceted hexagonal cross sections CrystEngComm, 2009, 11, 1863 |
7208746 | CIF | Bi2.5 Na0.5 Nb2 O9 | A 21 a m | 5.48888; 5.4611; 24.9512 90; 90; 90 | 747.92 | Long, Changbai; Fan, Huiqing; Li, Mengmeng; Li, Qiang Effect of lanthanum and tungsten co-substitution on the structure and properties of new Aurivillius oxides Na0.5La0.5Bi2Nb2-xWxO9 CrystEngComm, 2012, 14, 7201 |
7232465 | CIF | Bi3 Fe Mo2 O12 | C 1 2/c 1 | 16.927; 11.672; 5.263 90; 107.16; 90 | 993.5 | Li, Conggang; Gao, Zeliang; Tian, Xiangxin; Zhang, Junjie; Ju, Dianxing; Wu, Qian; Lu, Weiqun; Sun, Youxuan; Cui, Deliang; Tao, Xutang Bulk crystal growth and characterization of the bismuth ferrite-based material Bi3FeO4(MoO4)2 CrystEngComm, 2019, 21, 2508 |
7205491 | CIF | Br Cu H2 I2 O2 Pb2 | I 41/a c d :2 | 14.5579; 14.5579; 16.2961 90; 90; 90 | 3453.7 | Hu, Fei; Zhai, Quan-Guo; Li, Shu-Ni; Jiang, Yu-Cheng; Hu, Man-Cheng Ionothermal synthesis of a new (4,12)-connected heterometallic iodoplumbate with [Pb4(OH)4] cubane as joint points of the helices CrystEngComm, 2011, 13, 414 |
7223037 | CIF | Br2 Co H15 N6 O2 | C 1 2/c 1 | 10.6807; 8.8299; 10.9759 90; 94.604; 90 | 1031.79 | Zakharov, B. A.; Marchuk, A. S.; Boldyreva, E. V. A single-crystal to single-crystal phase transition in [Co(NH3)5NO2]Br2at high pressure: a step towards understanding linkage photo-isomerisation CrystEngComm, 2015, 17, 8812 |
7223038 | CIF | Br2 Co H15 N6 O2 | C 1 2/c 1 | 10.6575; 8.7649; 10.9567 90; 94.589; 90 | 1020.21 | Zakharov, B. A.; Marchuk, A. S.; Boldyreva, E. V. A single-crystal to single-crystal phase transition in [Co(NH3)5NO2]Br2at high pressure: a step towards understanding linkage photo-isomerisation CrystEngComm, 2015, 17, 8812 |
7223039 | CIF | Br2 Co H15 N6 O2 | C 1 2/c 1 | 10.6184; 8.6082; 10.9307 90; 94.591; 90 | 995.92 | Zakharov, B. A.; Marchuk, A. S.; Boldyreva, E. V. A single-crystal to single-crystal phase transition in [Co(NH3)5NO2]Br2at high pressure: a step towards understanding linkage photo-isomerisation CrystEngComm, 2015, 17, 8812 |
7223040 | CIF | Br2 Co H15 N6 O2 | C 1 2/c 1 | 10.6243; 8.403; 10.9113 90; 94.483; 90 | 971.14 | Zakharov, B. A.; Marchuk, A. S.; Boldyreva, E. V. A single-crystal to single-crystal phase transition in [Co(NH3)5NO2]Br2at high pressure: a step towards understanding linkage photo-isomerisation CrystEngComm, 2015, 17, 8812 |
7223041 | CIF | Br2 Co H15 N6 O2 | C 1 2/c 1 | 10.6792; 8.0977; 10.9004 90; 94.192; 90 | 940.11 | Zakharov, B. A.; Marchuk, A. S.; Boldyreva, E. V. A single-crystal to single-crystal phase transition in [Co(NH3)5NO2]Br2at high pressure: a step towards understanding linkage photo-isomerisation CrystEngComm, 2015, 17, 8812 |
7223042 | CIF | Br2 Co H15 N6 O2 | C 1 2/c 1 | 10.675; 7.8148; 10.8204 90; 93.829; 90 | 900.66 | Zakharov, B. A.; Marchuk, A. S.; Boldyreva, E. V. A single-crystal to single-crystal phase transition in [Co(NH3)5NO2]Br2at high pressure: a step towards understanding linkage photo-isomerisation CrystEngComm, 2015, 17, 8812 |
7223043 | CIF | Br2 Co H15 N6 O2 | C 1 2/c 1 | 10.6557; 7.7006; 10.7594 90; 93.693; 90 | 881.03 | Zakharov, B. A.; Marchuk, A. S.; Boldyreva, E. V. A single-crystal to single-crystal phase transition in [Co(NH3)5NO2]Br2at high pressure: a step towards understanding linkage photo-isomerisation CrystEngComm, 2015, 17, 8812 |
7223044 | CIF | Br2 Co H15 N6 O2 | C 1 2/c 1 | 10.6379; 7.6361; 10.7112 90; 93.601; 90 | 868.38 | Zakharov, B. A.; Marchuk, A. S.; Boldyreva, E. V. A single-crystal to single-crystal phase transition in [Co(NH3)5NO2]Br2at high pressure: a step towards understanding linkage photo-isomerisation CrystEngComm, 2015, 17, 8812 |
7223045 | CIF | Br2 Co H15 N6 O2 | C 1 2/c 1 | 10.6148; 7.568; 10.6476 90; 93.508; 90 | 853.75 | Zakharov, B. A.; Marchuk, A. S.; Boldyreva, E. V. A single-crystal to single-crystal phase transition in [Co(NH3)5NO2]Br2at high pressure: a step towards understanding linkage photo-isomerisation CrystEngComm, 2015, 17, 8812 |
7223046 | CIF | Br2 Co H15 N6 O2 | C 1 2/c 1 | 10.6023; 7.5308; 10.6049 90; 93.439; 90 | 845.21 | Zakharov, B. A.; Marchuk, A. S.; Boldyreva, E. V. A single-crystal to single-crystal phase transition in [Co(NH3)5NO2]Br2at high pressure: a step towards understanding linkage photo-isomerisation CrystEngComm, 2015, 17, 8812 |
7223047 | CIF | Br2 Co H15 N6 O2 | C 1 2/c 1 | 10.5931; 7.4783; 10.5357 90; 93.3; 90 | 833.24 | Zakharov, B. A.; Marchuk, A. S.; Boldyreva, E. V. A single-crystal to single-crystal phase transition in [Co(NH3)5NO2]Br2at high pressure: a step towards understanding linkage photo-isomerisation CrystEngComm, 2015, 17, 8812 |
7223048 | CIF | Br2 Co H15 N6 O2 | C 1 2/c 1 | 10.5914; 7.4435; 10.4601 90; 93.121; 90 | 823.42 | Zakharov, B. A.; Marchuk, A. S.; Boldyreva, E. V. A single-crystal to single-crystal phase transition in [Co(NH3)5NO2]Br2at high pressure: a step towards understanding linkage photo-isomerisation CrystEngComm, 2015, 17, 8812 |
7223049 | CIF | Br2 Co H15 N6 O2 | C m c m | 10.7595; 7.439; 10.089 90; 90; 90 | 807.52 | Zakharov, B. A.; Marchuk, A. S.; Boldyreva, E. V. A single-crystal to single-crystal phase transition in [Co(NH3)5NO2]Br2at high pressure: a step towards understanding linkage photo-isomerisation CrystEngComm, 2015, 17, 8812 |
7210786 | CIF | Br3 Hg2 I | C m c 21 | 4.6628; 7.013; 13.081 90; 90; 90 | 427.8 | Huang, Yin; Meng, Xianggao; Kang, Lei; Li, Yanjun; Zhong, Cheng; Lin, Zheshuai; Chen, Xingguo; Qin, Jingui Hg2Br3I: a new mixed halide nonlinear optical material in the infrared region CrystEngComm, 2013, 15, 4196 |
7215439 | CIF | Br4 Cd4 Hg4 S4 | C m m m | 9.0533; 18.467; 4.6354 90; 90; 90 | 775 | Zou, Jian-Ping; Peng, Qiang; Luo, Sheng-Lian; Tang, Xin-Hua; Zhang, Ai-Qin; Zeng, Gui-Sheng; Guo, Guo-Cong Synthesis, crystal and band structures, and optical properties of a novel quaternary mercury and cadmium chalcogenidehalide: (Hg2Cd2S2Br)Br CrystEngComm, 2011, 13, 3862 |
7214570 | CIF | Br4 Cu H12 N2 O2 | P 42/m n m | 7.9561; 7.9561; 8.2785 90; 90; 90 | 524.03 | Małuszyńska, Hanna; Tylczyński, Zbigniew; Cousson, Alain Ferroelastoelectric ordering in (NH4)2CuBr4·2H2O single crystal CrystEngComm, 2013, 15, 7498 |
7214571 | CIF | Br4 Cu H12 N2 O2 | P -4 21 m | 7.9005; 7.9005; 8.1982 90; 90; 90 | 511.71 | Małuszyńska, Hanna; Tylczyński, Zbigniew; Cousson, Alain Ferroelastoelectric ordering in (NH4)2CuBr4·2H2O single crystal CrystEngComm, 2013, 15, 7498 |
7214572 | CIF | Br4 Cu H12 N2 O2 | P 42/m n m | 7.994; 7.994; 8.275 90; 90; 90 | 528.81 | Małuszyńska, Hanna; Tylczyński, Zbigniew; Cousson, Alain Ferroelastoelectric ordering in (NH4)2CuBr4·2H2O single crystal CrystEngComm, 2013, 15, 7498 |
7214573 | CIF | Br4 Cu H12 N2 O2 | P -4 21 m | 7.869; 7.869; 8.248 90; 90; 90 | 510.73 | Małuszyńska, Hanna; Tylczyński, Zbigniew; Cousson, Alain Ferroelastoelectric ordering in (NH4)2CuBr4·2H2O single crystal CrystEngComm, 2013, 15, 7498 |
9017408 | CIF | C Ca O3 | P 65 | 7.112; 7.112; 25.4089 90; 90; 120 | 1113.01 | Demichelis, R.; Raiteri, P.; Gale, J. D.; Dovesi, R. A new structural model for disorder in vaterite from first-principles calculations CrystEngComm, 2012, 14, 44-47 |
9017409 | CIF | C Ca O3 | P 32 2 1 | 7.1239; 7.1239; 25.3203 90; 90; 120 | 1112.85 | Demichelis, R.; Raiteri, P.; Gale, J. D.; Dovesi, R. A new structural model for disorder in vaterite from first-principles calculations CrystEngComm, 2012, 14, 44-47 |
9017410 | CIF | C Ca O3 | A m a 2 | 8.4905; 6.3905; 4.5026 90; 90; 90 | 244.305 | Demichelis, R.; Raiteri, P.; Gale, J. D.; Dovesi, R. A new structural model for disorder in vaterite from first-principles calculations CrystEngComm, 2012, 14, 44-47 |
9017411 | CIF | C Ca O3 | P 21 21 21 | 4.3668; 6.5831; 8.4282 90; 90; 90 | 242.286 | Demichelis, R.; Raiteri, P.; Gale, J. D.; Dovesi, R. A new structural model for disorder in vaterite from first-principles calculations CrystEngComm, 2012, 14, 44-47 |
7204864 | CIF | C Cl N2 S2 | P -1 | 8.3393; 9.4759; 11.9105 102.8; 90.1883; 104.761 | 885.74 | Clarke, Caroline S.; Pascu, Sofia I.; Rawson, Jeremy M. Further studies on the polymorphic dithiadiazolyl radical, ClCNSSN CrystEngComm, 2004, 6, 79 |
7233455 | CIF | C D3 N2 O | I 1 2/a 1 | 9.337; 4.60528; 11.4184 90; 82.134; 90 | 486.37 | Bull, Craig L.; Funnell, Nicholas P.; Ridley, Christopher J.; Pulham, Colin R.; Coster, Paul L.; Tellam, James P.; Marshall, William G. Pressure-induced isosymmetric phase transition in biurea CrystEngComm, 2019, 21, 5872 |
7233456 | CIF | C D3 N2 O | I 1 2/a 1 | 9.3394; 4.57648; 11.3816 90; 82.16; 90 | 481.92 | Bull, Craig L.; Funnell, Nicholas P.; Ridley, Christopher J.; Pulham, Colin R.; Coster, Paul L.; Tellam, James P.; Marshall, William G. Pressure-induced isosymmetric phase transition in biurea CrystEngComm, 2019, 21, 5872 |
7233457 | CIF | C D3 N2 O | I 1 2/a 1 | 9.485; 3.70468; 12.9889 90; 77.632; 90 | 445.82 | Bull, Craig L.; Funnell, Nicholas P.; Ridley, Christopher J.; Pulham, Colin R.; Coster, Paul L.; Tellam, James P.; Marshall, William G. Pressure-induced isosymmetric phase transition in biurea CrystEngComm, 2019, 21, 5872 |
7233458 | CIF | C D3 N2 O | I 1 2/a 1 | 9.4444; 3.46902; 13.1315 90; 77.318; 90 | 419.73 | Bull, Craig L.; Funnell, Nicholas P.; Ridley, Christopher J.; Pulham, Colin R.; Coster, Paul L.; Tellam, James P.; Marshall, William G. Pressure-induced isosymmetric phase transition in biurea CrystEngComm, 2019, 21, 5872 |
7233459 | CIF | C D3 N2 O | I 1 2/a 1 | 9.4568; 3.51779; 13.1178 90; 77.346; 90 | 425.79 | Bull, Craig L.; Funnell, Nicholas P.; Ridley, Christopher J.; Pulham, Colin R.; Coster, Paul L.; Tellam, James P.; Marshall, William G. Pressure-induced isosymmetric phase transition in biurea CrystEngComm, 2019, 21, 5872 |
7233460 | CIF | C D3 N2 O | I 1 2/a 1 | 9.4526; 3.49778; 13.1229 90; 77.341; 90 | 423.34 | Bull, Craig L.; Funnell, Nicholas P.; Ridley, Christopher J.; Pulham, Colin R.; Coster, Paul L.; Tellam, James P.; Marshall, William G. Pressure-induced isosymmetric phase transition in biurea CrystEngComm, 2019, 21, 5872 |
7233461 | CIF | C D3 N2 O | I 1 2/a 1 | 9.338; 4.59377; 11.4034 90; 82.154; 90 | 484.59 | Bull, Craig L.; Funnell, Nicholas P.; Ridley, Christopher J.; Pulham, Colin R.; Coster, Paul L.; Tellam, James P.; Marshall, William G. Pressure-induced isosymmetric phase transition in biurea CrystEngComm, 2019, 21, 5872 |
7233462 | CIF | C D3 N2 O | I 1 2/a 1 | 9.3429; 4.55499; 11.3567 90; 82.183; 90 | 478.81 | Bull, Craig L.; Funnell, Nicholas P.; Ridley, Christopher J.; Pulham, Colin R.; Coster, Paul L.; Tellam, James P.; Marshall, William G. Pressure-induced isosymmetric phase transition in biurea CrystEngComm, 2019, 21, 5872 |
7233463 | CIF | C D3 N2 O | I 1 2/a 1 | 9.4344; 3.44007; 13.1345 90; 77.317; 90 | 415.88 | Bull, Craig L.; Funnell, Nicholas P.; Ridley, Christopher J.; Pulham, Colin R.; Coster, Paul L.; Tellam, James P.; Marshall, William G. Pressure-induced isosymmetric phase transition in biurea CrystEngComm, 2019, 21, 5872 |
7233464 | CIF | C D3 N2 O | I 1 2/a 1 | 9.4644; 3.5503; 13.1017 90; 77.388; 90 | 429.61 | Bull, Craig L.; Funnell, Nicholas P.; Ridley, Christopher J.; Pulham, Colin R.; Coster, Paul L.; Tellam, James P.; Marshall, William G. Pressure-induced isosymmetric phase transition in biurea CrystEngComm, 2019, 21, 5872 |
7233465 | CIF | C D3 N2 O | I 1 2/a 1 | 9.4768; 3.61125; 13.0677 90; 77.463; 90 | 436.55 | Bull, Craig L.; Funnell, Nicholas P.; Ridley, Christopher J.; Pulham, Colin R.; Coster, Paul L.; Tellam, James P.; Marshall, William G. Pressure-induced isosymmetric phase transition in biurea CrystEngComm, 2019, 21, 5872 |
7233466 | CIF | C D3 N2 O | I 1 2/a 1 | 9.419; 3.39405; 13.1379 90; 77.31; 90 | 409.74 | Bull, Craig L.; Funnell, Nicholas P.; Ridley, Christopher J.; Pulham, Colin R.; Coster, Paul L.; Tellam, James P.; Marshall, William G. Pressure-induced isosymmetric phase transition in biurea CrystEngComm, 2019, 21, 5872 |
7233467 | CIF | C D3 N2 O | I 1 2/a 1 | 9.4251; 3.41438; 13.1382 90; 77.309; 90 | 412.47 | Bull, Craig L.; Funnell, Nicholas P.; Ridley, Christopher J.; Pulham, Colin R.; Coster, Paul L.; Tellam, James P.; Marshall, William G. Pressure-induced isosymmetric phase transition in biurea CrystEngComm, 2019, 21, 5872 |
7233468 | CIF | C D3 N2 O | I 1 2/a 1 | 9.4033; 3.35415; 13.132 90; 77.321; 90 | 404.08 | Bull, Craig L.; Funnell, Nicholas P.; Ridley, Christopher J.; Pulham, Colin R.; Coster, Paul L.; Tellam, James P.; Marshall, William G. Pressure-induced isosymmetric phase transition in biurea CrystEngComm, 2019, 21, 5872 |
7233469 | CIF | C D3 N2 O | I 1 2/a 1 | 9.4113; 3.37412; 13.1358 90; 77.317; 90 | 406.95 | Bull, Craig L.; Funnell, Nicholas P.; Ridley, Christopher J.; Pulham, Colin R.; Coster, Paul L.; Tellam, James P.; Marshall, William G. Pressure-induced isosymmetric phase transition in biurea CrystEngComm, 2019, 21, 5872 |
7233470 | CIF | C D3 N2 O | I 1 2/a 1 | 9.4872; 3.81402; 12.8589 90; 77.936; 90 | 455.02 | Bull, Craig L.; Funnell, Nicholas P.; Ridley, Christopher J.; Pulham, Colin R.; Coster, Paul L.; Tellam, James P.; Marshall, William G. Pressure-induced isosymmetric phase transition in biurea CrystEngComm, 2019, 21, 5872 |
7233471 | CIF | C D3 N2 O | I 1 2/a 1 | 9.3926; 3.33285; 13.1269 90; 77.329; 90 | 400.92 | Bull, Craig L.; Funnell, Nicholas P.; Ridley, Christopher J.; Pulham, Colin R.; Coster, Paul L.; Tellam, James P.; Marshall, William G. Pressure-induced isosymmetric phase transition in biurea CrystEngComm, 2019, 21, 5872 |
7233472 | CIF | C D3 N2 O | I 1 2/a 1 | 9.3308; 4.6415; 11.4721 90; 82.069; 90 | 492.09 | Bull, Craig L.; Funnell, Nicholas P.; Ridley, Christopher J.; Pulham, Colin R.; Coster, Paul L.; Tellam, James P.; Marshall, William G. Pressure-induced isosymmetric phase transition in biurea CrystEngComm, 2019, 21, 5872 |
7233473 | CIF | C D3 N2 O | I 1 2/a 1 | 9.3332; 4.6196; 11.4456 90; 82.101; 90 | 488.8 | Bull, Craig L.; Funnell, Nicholas P.; Ridley, Christopher J.; Pulham, Colin R.; Coster, Paul L.; Tellam, James P.; Marshall, William G. Pressure-induced isosymmetric phase transition in biurea CrystEngComm, 2019, 21, 5872 |
7215799 | CIF | C H B F N O | P 1 21/c 1 | 17.415; 8.8817; 23.87 90; 97.56; 90 | 3660 | Luo, Yang-Hui; Wu, Dong-En; Song, Wen-Tao; Ge, Shu-Wang; Sun, Bai-Wang Positions of amino groups on ammonium salts tunes the conformations of crown ethers: crystal structures, Hirshfeld surfaces and spectroscopic studies CrystEngComm, 2014, 16, 5319 |
7221053 | CIF | C H Cd Cl K N O | P a -3 | 20.496; 20.496; 20.496 90; 90; 90 | 8610 | Zheng, Bao-Hua; Hao, Xue-Na; An, Bo; Qiao, Jin-Zhong; Hu, Tuo-Ping Ion template effects of 4,5-dicyanoimidazole in the assembly of a series of 3D bimetallic coordination networks CrystEngComm, 2015, 17, 6103 |
7221059 | CIF | C H Cd I N O Rb | P a -3 | 20.7438; 20.7438; 20.7438 90; 90; 90 | 8926.2 | Zheng, Bao-Hua; Hao, Xue-Na; An, Bo; Qiao, Jin-Zhong; Hu, Tuo-Ping Ion template effects of 4,5-dicyanoimidazole in the assembly of a series of 3D bimetallic coordination networks CrystEngComm, 2015, 17, 6103 |
7211802 | CIF | C H Cl3 | P n m a | 7.4422; 9.4578; 5.8025 90; 90; 90 | 408.42 | Yufit, D. S.; Howard, J. A. K. Low-melting molecular complexes of chloroform CrystEngComm, 2010, 12, 737 |
7210986 | CIF | C H Co N O | P 42/m | 15.0103; 15.0103; 10.0791 90; 90; 90 | 2270.9 | Hu, Fei-Long; Mi, Yan; Gu, Yun-Qiong; Zhu, Li-Gang; Yang, Sheng-Lan; Wei, Han; Lang, Jian-Ping Structure diversities of ten entangled coordination polymers assembled from reactions of Co(ii) or Ni(ii) salts with 5-(pyridin-4-yl)isophthalic acid in the absence or presence of auxiliary N-donor ligands CrystEngComm, 2013, 15, 9553 |
7210991 | CIF | C H Co N O | P 1 2/c 1 | 12.824; 10.318; 31.48 90; 101.75; 90 | 4078 | Hu, Fei-Long; Mi, Yan; Gu, Yun-Qiong; Zhu, Li-Gang; Yang, Sheng-Lan; Wei, Han; Lang, Jian-Ping Structure diversities of ten entangled coordination polymers assembled from reactions of Co(ii) or Ni(ii) salts with 5-(pyridin-4-yl)isophthalic acid in the absence or presence of auxiliary N-donor ligands CrystEngComm, 2013, 15, 9553 |
7220386 | CIF | C H Cu N7 | P 21 21 21 | 6.7352; 7.5089; 9.6823 90; 90; 90 | 489.67 | Xie, Ya-Bo; Gan, Lei; Carolina Sañudo, E.; Zheng, Haiyang; Zhao, Jiongpeng; Zhao, Minjian; Wang, Bin; Li, Jian-Rong Tetrazolate‒azido‒copper(ii) coordination polymers: tuned synthesis, structure, and magnetic properties CrystEngComm, 2015, 17, 4136 |
7223768 | CIF | C H Li O2 | C 1 2/c 1 | 12.0297; 12.0413; 13.5174 90; 100.597; 90 | 1924.64 | Tominaka, Satoshi; Yeung, Hamish H.-M.; Henke, Sebastian; Cheetham, Anthony K. Coordination environments and π-conjugation in dense lithium coordination polymers CrystEngComm, 2016, 18, 398 |
7223769 | CIF | C H Li O2 | C 1 2/c 1 | 12.0519; 12.0497; 13.5108 90; 101.003; 90 | 1925.99 | Tominaka, Satoshi; Yeung, Hamish H.-M.; Henke, Sebastian; Cheetham, Anthony K. Coordination environments and π-conjugation in dense lithium coordination polymers CrystEngComm, 2016, 18, 398 |
7243060 | CIF | C H O S | P -1 | 8.301; 18.954; 20.558 114.88; 96.22; 95.19 | 2884 | Gao, Xiang-Yu; Li, Yu-Lin; Liu, Tian-Fu; Huang, Xin-Song; Cao, Rong Single-crystal-to-single-crystal transformation of tetrathiafulvalene-based hydrogen-bonded organic frameworks CrystEngComm, 2021, 23, 4743-4747 |
7203221 | CIF | C H18 Cl2 Co N7 Se | C 1 2/m 1 | 12.948; 7.334; 13.849 90; 115.35; 90 | 1188.5 | Pal Sharma, Raj; Bala, Ritu; Sharma, Rajni; Venugopalan, Paloth ‘Rings and rectangles’ mediated through weak interactions in ionic solids: Synthesis and packing analysis of [Co(NH3)6]Cl2SeCN and [Co(NH3)6]3Cl4(N3)5 in the crystalline state CrystEngComm, 2006, 8, 215 |
7218271 | CIF | C H2 Ag N5 | P 1 21/c 1 | 3.4771; 10.671; 10.22 90; 94.143; 90 | 378.21 | Zhang, Qi; Chen, Dong; He, Xuan; Huang, Shiliang; Huang, Jinglun; Zhou, Xiaoqing; Yang, Zongwei; Li, Jinshan; Li, Hongzhen; Nie, Fude Structures, photoluminescence and photocatalytic properties of two novel metal‒organic frameworks based on tetrazole derivatives CrystEngComm, 2014, 16, 10485 |
7202132 | CIF | C H2 Br I | C 1 2/c 1 | 12.905; 4.573; 16.072 90; 114.79; 90 | 861.1 | Podsiadło, Marcin; Katrusiak, Andrzej Isostructural relations in dihalomethanes and disproportionation of bromoiodomethane CrystEngComm, 2008, 10, 1436 |
7202133 | CIF | C H2 Br I | C 1 2/c 1 | 12.817; 4.5223; 15.757 90; 114.45; 90 | 831.4 | Podsiadło, Marcin; Katrusiak, Andrzej Isostructural relations in dihalomethanes and disproportionation of bromoiodomethane CrystEngComm, 2008, 10, 1436 |
7202134 | CIF | C H2 Br I | C 1 2/c 1 | 12.649; 4.4767; 15.425 90; 112.98; 90 | 804.1 | Podsiadło, Marcin; Katrusiak, Andrzej Isostructural relations in dihalomethanes and disproportionation of bromoiodomethane CrystEngComm, 2008, 10, 1436 |
7226507 | CIF | C H2 Cl Hg N5 | P 1 21/n 1 | 8.1233; 6.9274; 8.7456 90; 93.122; 90 | 491.41 | Liu, Dong-Sheng; Chen, Wen-Tong; Huang, Jian-Gen; Cheng, Xiao-Di; Wang, Jie; Sui, Yan Syntheses, structures and investigation of the properties of mercury coordination polymers based on 5-amino-tetrazolate ligands CrystEngComm, 2016, 18, 7865 |
7226508 | CIF | C H2 Cl Hg N5 | P 1 21 1 | 5.8459; 6.9731; 6.1725 90; 94.27; 90 | 250.92 | Liu, Dong-Sheng; Chen, Wen-Tong; Huang, Jian-Gen; Cheng, Xiao-Di; Wang, Jie; Sui, Yan Syntheses, structures and investigation of the properties of mercury coordination polymers based on 5-amino-tetrazolate ligands CrystEngComm, 2016, 18, 7865 |
7200699 | CIF | C H2 Cl I | P n a 21 | 7.9666; 4.8702; 21.351 90; 90; 90 | 828.4 | Podsiadło, Marcin; Katrusiak, Andrzej Electrostatic matching in phase IV of chloroiodomethane: a new aggregation pattern in the isostructural classes of dihalomethanes CrystEngComm, 2009, 11, 1391 |
7226506 | CIF | C H2 Hg N5 | P 1 21/c 1 | 5.0952; 13.021; 6.8264 90; 105.26; 90 | 436.93 | Liu, Dong-Sheng; Chen, Wen-Tong; Huang, Jian-Gen; Cheng, Xiao-Di; Wang, Jie; Sui, Yan Syntheses, structures and investigation of the properties of mercury coordination polymers based on 5-amino-tetrazolate ligands CrystEngComm, 2016, 18, 7865 |
7202135 | CIF | C H2 I2 | F m m 2 | 7.0153; 12.599; 4.5877 90; 90; 90 | 405.49 | Podsiadło, Marcin; Katrusiak, Andrzej Isostructural relations in dihalomethanes and disproportionation of bromoiodomethane CrystEngComm, 2008, 10, 1436 |
7216473 | CIF | C H3 Br | P n m a | 4.372; 6.375; 9.196 90; 90; 90 | 256.3 | Podsiadło, Marcin; Olejniczak, Anna; Katrusiak, Andrzej Halogen∙∙∙halogen contra C−H∙∙∙halogen CrystEngComm, 2014 |
7216474 | CIF | C H3 Br | P n m a | 4.331; 6.358; 9.142 90; 90; 90 | 251.7 | Podsiadło, Marcin; Olejniczak, Anna; Katrusiak, Andrzej Halogen∙∙∙halogen contra C−H∙∙∙halogen CrystEngComm, 2014 |
7216475 | CIF | C H3 Br | C m c 21 | 6.387; 5.163; 7.492 90; 90; 90 | 247.1 | Podsiadło, Marcin; Olejniczak, Anna; Katrusiak, Andrzej Halogen∙∙∙halogen contra C−H∙∙∙halogen CrystEngComm, 2014 |
7216476 | CIF | C H3 Br | C m c 21 | 6.378; 5.133; 7.413 90; 90; 90 | 242.7 | Podsiadło, Marcin; Olejniczak, Anna; Katrusiak, Andrzej Halogen∙∙∙halogen contra C−H∙∙∙halogen CrystEngComm, 2014 |
7216477 | CIF | C H3 Br | C m c 21 | 6.236; 5.017; 7.394 90; 90; 90 | 231.3 | Podsiadło, Marcin; Olejniczak, Anna; Katrusiak, Andrzej Halogen∙∙∙halogen contra C−H∙∙∙halogen CrystEngComm, 2014 |
7216469 | CIF | C H3 Cl | C m c 21 | 6.314; 5.031; 7.334 90; 90; 90 | 233 | Podsiadło, Marcin; Olejniczak, Anna; Katrusiak, Andrzej Halogen∙∙∙halogen contra C−H∙∙∙halogen CrystEngComm, 2014 |
7216470 | CIF | C H3 Cl | C m c 21 | 6.183; 4.904; 7.317 90; 90; 90 | 221.9 | Podsiadło, Marcin; Olejniczak, Anna; Katrusiak, Andrzej Halogen∙∙∙halogen contra C−H∙∙∙halogen CrystEngComm, 2014 |
7216471 | CIF | C H3 Cl | C m c 21 | 6.018; 4.832; 7.035 90; 90; 90 | 204.6 | Podsiadło, Marcin; Olejniczak, Anna; Katrusiak, Andrzej Halogen∙∙∙halogen contra C−H∙∙∙halogen CrystEngComm, 2014 |
7216472 | CIF | C H3 Cl | C m c 21 | 5.967; 4.708; 6.984 90; 90; 90 | 196.2 | Podsiadło, Marcin; Olejniczak, Anna; Katrusiak, Andrzej Halogen∙∙∙halogen contra C−H∙∙∙halogen CrystEngComm, 2014 |
7201032 | CIF | C H3 I | P n m a | 4.4968; 6.8417; 9.941 90; 90; 90 | 305.84 | Podsiadło, Marcin; Katrusiak, Andrzej High-pressure crystal structure of methyl iodide: molecular aggregation in the crystals of halomethanes and their isostructural relations, CrystEngComm, 2009, 11, 1951 |
7201033 | CIF | C H3 I | P n m a | 4.3643; 6.6826; 9.773 90; 90; 90 | 285.03 | Podsiadło, Marcin; Katrusiak, Andrzej High-pressure crystal structure of methyl iodide: molecular aggregation in the crystals of halomethanes and their isostructural relations, CrystEngComm, 2009, 11, 1951 |
7201034 | CIF | C H3 I | P n m a | 4.2676; 6.572; 9.611 90; 90; 90 | 269.6 | Podsiadło, Marcin; Katrusiak, Andrzej High-pressure crystal structure of methyl iodide: molecular aggregation in the crystals of halomethanes and their isostructural relations, CrystEngComm, 2009, 11, 1951 |
7205235 | CIF | C H3 N5 | P 21 21 21 | 5.09; 3.6663; 18.0741 90; 90; 90 | 337.289 | Fujihisa, Hiroshi; Honda, Kazumasa; Obata, Shigeaki; Yamawaki, Hiroshi; Takeya, Satoshi; Gotoh, Yoshito; Matsunaga, Takehiro Crystal structure of anhydrous 5-aminotetrazole and its high-pressure behavior CrystEngComm, 2011, 13, 99 |
7205236 | CIF | C H3 N5 | P 21 21 21 | 4.9624; 3.2575; 17.5375 90; 90; 90 | 283.494 | Fujihisa, Hiroshi; Honda, Kazumasa; Obata, Shigeaki; Yamawaki, Hiroshi; Takeya, Satoshi; Gotoh, Yoshito; Matsunaga, Takehiro Crystal structure of anhydrous 5-aminotetrazole and its high-pressure behavior CrystEngComm, 2011, 13, 99 |
7205237 | CIF | C H3 N5 | P 21 21 21 | 4.8628; 3.0809; 17.2703 90; 90; 90 | 258.74 | Fujihisa, Hiroshi; Honda, Kazumasa; Obata, Shigeaki; Yamawaki, Hiroshi; Takeya, Satoshi; Gotoh, Yoshito; Matsunaga, Takehiro Crystal structure of anhydrous 5-aminotetrazole and its high-pressure behavior CrystEngComm, 2011, 13, 99 |
7246587 | CIF | C H4 N2 O2 | I 41/a :2 | 9.197; 9.197; 14.6568 90; 90; 90 | 1239.74 | Rai, Sunil K.; Tothadi, Srinu; Arhangelskis, Mihails; George, Christy P.; Gonnade, Rajesh G.; Nangia, Ashwini K. Polymorph II of hydroxyurea 150 years after its first synthesis CrystEngComm, 2023, 25, 2712-2716 |
7246588 | CIF | C H4 N2 O2 | P 1 21/c 1 | 8.3422; 4.8944; 8.7962 90; 122.423; 90 | 303.16 | Rai, Sunil K.; Tothadi, Srinu; Arhangelskis, Mihails; George, Christy P.; Gonnade, Rajesh G.; Nangia, Ashwini K. Polymorph II of hydroxyurea 150 years after its first synthesis CrystEngComm, 2023, 25, 2712-2716 |
7245600 | CIF | C H4 O | P 1 21/c 1 | 4.3989; 11.809; 10.981 90; 126.69; 90 | 457.4 | Aldum, J. Collen; Jones, Isabelle; McGonigal, Paul R.; Spagnoli, Dino; Stapleton, Nicholas D.; Turner, Gemma F.; Moggach, Stephen A. The structure of methanol at 5.09 GPa: the fortuitous formation of a new high-pressure phase CrystEngComm, 2022 |
7203054 | CIF | C H5 N3 O4 | P 1 21/c 1 | 7.9761; 8.2004; 7.3668 90; 103.414; 90 | 468.697 | Nelyubina, Yulia V.; Lyssenko, Konstantin A.; Golovanov, Denis G.; Antipin, Mikhail Yu. NO3‒⋯NO3‒ and NO3‒⋯π interactions in the crystal of urea nitrate CrystEngComm, 2007, 9, 991 |
7215988 | CIF | C H6 B F4 N3 | R 3 m :H | 7.4241; 7.4241; 8.7784 90; 90; 120 | 419.02 | Szafrański, Marek Effect of high pressure on the supramolecular structures of guanidinium based ferroelectrics CrystEngComm, 2014 |
7215989 | CIF | C H6 B F4 N3 | R 3 m :H | 7.4121; 7.4121; 8.65 90; 90; 120 | 411.6 | Szafrański, Marek Effect of high pressure on the supramolecular structures of guanidinium based ferroelectrics CrystEngComm, 2014 |
7215990 | CIF | C H6 B F4 N3 | R 3 m :H | 7.4031; 7.4031; 8.5486 90; 90; 120 | 405.74 | Szafrański, Marek Effect of high pressure on the supramolecular structures of guanidinium based ferroelectrics CrystEngComm, 2014 |
7215991 | CIF | C H6 B F4 N3 | R 3 :H | 7.4011; 7.4011; 8.3856 90; 90; 120 | 397.79 | Szafrański, Marek Effect of high pressure on the supramolecular structures of guanidinium based ferroelectrics CrystEngComm, 2014 |
7215992 | CIF | C H6 B F4 N3 | R 3 :H | 7.3983; 7.3983; 8.346 90; 90; 120 | 395.62 | Szafrański, Marek Effect of high pressure on the supramolecular structures of guanidinium based ferroelectrics CrystEngComm, 2014 |
7215993 | CIF | C H6 B F4 N3 | R 3 :H | 7.3952; 7.3952; 8.2763 90; 90; 120 | 391.98 | Szafrański, Marek Effect of high pressure on the supramolecular structures of guanidinium based ferroelectrics CrystEngComm, 2014 |
7215994 | CIF | C H6 B F4 N3 | R 3 :H | 7.3751; 7.3751; 8.127 90; 90; 120 | 382.82 | Szafrański, Marek Effect of high pressure on the supramolecular structures of guanidinium based ferroelectrics CrystEngComm, 2014 |
7215995 | CIF | C H6 B F4 N3 | R 3 :H | 7.3558; 7.3558; 7.989 90; 90; 120 | 374.35 | Szafrański, Marek Effect of high pressure on the supramolecular structures of guanidinium based ferroelectrics CrystEngComm, 2014 |
7215996 | CIF | C H6 Cl N3 O4 | R 3 m :H | 7.5595; 7.5595; 8.7694 90; 90; 120 | 434 | Szafrański, Marek Effect of high pressure on the supramolecular structures of guanidinium based ferroelectrics CrystEngComm, 2014 |
7215997 | CIF | C H6 Cl N3 O4 | R 3 m :H | 7.5534; 7.5534; 8.6935 90; 90; 120 | 429.55 | Szafrański, Marek Effect of high pressure on the supramolecular structures of guanidinium based ferroelectrics CrystEngComm, 2014 |
7215998 | CIF | C H6 Cl N3 O4 | R 3 m :H | 7.531; 7.531; 8.4767 90; 90; 120 | 416.35 | Szafrański, Marek Effect of high pressure on the supramolecular structures of guanidinium based ferroelectrics CrystEngComm, 2014 |
7215999 | CIF | C H6 Cl N3 O4 | R 3 m :H | 7.5123; 7.5123; 8.3522 90; 90; 120 | 408.2 | Szafrański, Marek Effect of high pressure on the supramolecular structures of guanidinium based ferroelectrics CrystEngComm, 2014 |
7216000 | CIF | C H6 Cl N3 O4 | R 3 m :H | 7.4965; 7.4965; 8.2508 90; 90; 120 | 401.55 | Szafrański, Marek Effect of high pressure on the supramolecular structures of guanidinium based ferroelectrics CrystEngComm, 2014 |
7231905 | CIF | C H6 Cl3 N Pb | P m -3 m | 5.6867; 5.6867; 5.6867 90; 90; 90 | 183.9 | Nandi, Pronoy; Giri, Chandan; Swain, Diptikanta; Manju, U.; Topwal, Dinesh Room temperature growth of CH3NH3PbCl3 single crystals by solvent evaporation method CrystEngComm, 2019, 21, 656 |
7210067 | CIF | C H6 I N3 | P 63 m c | 7.1512; 7.1512; 11.963 90; 90; 120 | 529.82 | Szafrański, Marek; Jarek, Marcin Origin of spontaneous polarization and reconstructive phase transition in guanidinium iodide CrystEngComm, 2013, 15, 4617 |
7210068 | CIF | C H6 I N3 | P 63 m c | 7.1641; 7.1641; 12.0317 90; 90; 120 | 534.79 | Szafrański, Marek; Jarek, Marcin Origin of spontaneous polarization and reconstructive phase transition in guanidinium iodide CrystEngComm, 2013, 15, 4617 |
7210069 | CIF | C H6 I N3 | P 63 m c | 7.17619; 7.17619; 12.1229 90; 90; 120 | 540.66 | Szafrański, Marek; Jarek, Marcin Origin of spontaneous polarization and reconstructive phase transition in guanidinium iodide CrystEngComm, 2013, 15, 4617 |
7210070 | CIF | C H6 I N3 | P 63 m c | 7.18791; 7.18791; 12.229 90; 90; 120 | 547.176 | Szafrański, Marek; Jarek, Marcin Origin of spontaneous polarization and reconstructive phase transition in guanidinium iodide CrystEngComm, 2013, 15, 4617 |
7210071 | CIF | C H6 I N3 | P 63 m c | 7.19508; 7.19508; 12.2986 90; 90; 120 | 551.388 | Szafrański, Marek; Jarek, Marcin Origin of spontaneous polarization and reconstructive phase transition in guanidinium iodide CrystEngComm, 2013, 15, 4617 |
7210072 | CIF | C H6 I N3 | P 63 m c | 7.20163; 7.20163; 12.3501 90; 90; 120 | 554.706 | Szafrański, Marek; Jarek, Marcin Origin of spontaneous polarization and reconstructive phase transition in guanidinium iodide CrystEngComm, 2013, 15, 4617 |
7210073 | CIF | C H6 I N3 | P 63 m c | 7.20634; 7.20634; 12.402 90; 90; 120 | 557.77 | Szafrański, Marek; Jarek, Marcin Origin of spontaneous polarization and reconstructive phase transition in guanidinium iodide CrystEngComm, 2013, 15, 4617 |
7210074 | CIF | C H6 I N3 | P 63 m c | 7.21109; 7.21109; 12.461 90; 90; 120 | 561.16 | Szafrański, Marek; Jarek, Marcin Origin of spontaneous polarization and reconstructive phase transition in guanidinium iodide CrystEngComm, 2013, 15, 4617 |
7210075 | CIF | C H6 I N3 | P 1 21/m 1 | 5.23783; 7.54922; 6.98292 90; 96.7315; 90 | 274.212 | Szafrański, Marek; Jarek, Marcin Origin of spontaneous polarization and reconstructive phase transition in guanidinium iodide CrystEngComm, 2013, 15, 4617 |
7218931 | CIF | C H6 I3 N Pb | I 4 c m | 8.896; 8.896; 12.637 90; 90; 90 | 1000.1 | Dang, Yangyang; Liu, Yang; Sun, Youxuan; Yuan, Dongsheng; Liu, Xiaolong; Lu, Weiqun; Liu, Guangfeng; Xia, Haibing; Tao, Xutang Bulk crystal growth of hybrid perovskite material CH3NH3PbI3 CrystEngComm, 2015, 17, 665 |
7225287 | CIF | C H6 I3 N Pb | P m -3 m | 6.2723; 6.2723; 6.2723 90; 90; 90 | 246.76 | Luan, Mengyu; Song, Junling; Wei, Xiangfeng; Chen, Fang; Liu, Jiehua Controllable growth of bulk cubic-phase CH3NH3PbI3single crystal with exciting room-temperature stability CrystEngComm, 2016, 18, 5257 |
7227818 | CIF | C H7 Cl Cu N2 O6 | P n m a | 7.4087; 7.8568; 12.3745 90; 90; 90 | 720.3 | Bovill, Sally M.; Dixey, Richard J. C.; Saines, Paul J. Three coordination frameworks with copper formate based low dimensional motifs: synthesis, structure and magnetic properties CrystEngComm, 2017, 19, 1831 |
7227817 | CIF | C H7 Cu N3 O5 | P m n b | 7.1767; 7.3661; 12.3418 90; 90; 90 | 652.44 | Bovill, Sally M.; Dixey, Richard J. C.; Saines, Paul J. Three coordination frameworks with copper formate based low dimensional motifs: synthesis, structure and magnetic properties CrystEngComm, 2017, 19, 1831 |
7220387 | CIF | C H7 Cu N9 | C 1 2/c 1 | 11.804; 5.7178; 10.984 90; 115.84; 90 | 667.2 | Xie, Ya-Bo; Gan, Lei; Carolina Sañudo, E.; Zheng, Haiyang; Zhao, Jiongpeng; Zhao, Minjian; Wang, Bin; Li, Jian-Rong Tetrazolate‒azido‒copper(ii) coordination polymers: tuned synthesis, structure, and magnetic properties CrystEngComm, 2015, 17, 4136 |
7245132 | CIF | C H7 N10 Na2 O2.5 | P 32 2 1 | 9.6556; 9.6556; 18.7426 90; 90; 120 | 1513.28 | Xu, Yuangang; Xu, Ze; Zhang, Xiaopeng; Hou, Tianyang; Lu, Ming [Na4(N5)4(H2O)2]·H2O·2MeOH: a honeycomb-like sodium pentazolate framework with helical chains CrystEngComm, 2022 |
7215357 | CIF | C H8 As N O3 | P 1 21 1 | 5.47942; 4.65117; 10.4691 90; 94.937; 90 | 265.823 | Guńka, Piotr A.; Dranka, Maciej; Zachara, Janusz Supramolecular structure of ammonium polyoxoarsenates(iii) CrystEngComm, 2011, 13, 6163 |
7246896 | CIF | C H8 B9 I N2 | C 1 c 1 | 16.2967; 6.5799; 11.8991 90; 126.545; 90 | 1025.08 | Pietrzak, Anna; Carr, Michael J.; Kaszyński, Piotr Substituent effects on the [1-closo-CB9H10]− anion geometry: experimental and DFT studies CrystEngComm, 2023, 25, 3790-3798 |
7233842 | CIF | C H8 Cl N3 O | P m n a | 7.909; 17.113; 8.049 90; 90; 90 | 1089.4 | Wang, Ya; Han, Jian; Tudi, Abudukadi; Zhang, Zhizhong; Yang, Zhihua; Pan, Shilie CO(NH2)2·NH4Cl: an ultraviolet birefringent material with conjugated CO groups CrystEngComm, 2019, 21, 6072 |
7246910 | CIF | C Na3 O8 P V | P 1 21/m 1 | 6.3646; 6.3135; 8.8975 90; 110.334; 90 | 335.25 | Yakubovich, Olga; Kiriukhina, Galina; Simonov, Sergey; Volkov, Anatoly; Dimitrova, Olga Na3(VO)(PO4)(CO3): a synthetic member of the bradleyite phosphate carbonate family with a new type of crystal structure CrystEngComm, 2023, 25, 4024-4032 |
7232417 | CIF | C0 H0 Ca0 Co Cs11 K4 Na3 Nb12 O187 Si4 W36 | P -1 | 12.999; 19.174; 20.681 77.303; 75.251; 83.327 | 4853 | Wu, Hai-Yang; Huang, Min; Qin, Chao; Wang, Xin-Long; Hu, Hai; Huang, Peng; Su, Zhong-Min Self-assembly and Li-ion storage performance of three new Nb/W mixed-addendum polyoxometalates based on the {SiNb3W9O40} clusters and transition-metal cations CrystEngComm, 2019, 21, 1862 |
7232416 | CIF | C0 H0 Cs14 K4 Nb12 Ni O199 Si4 W36 | P -1 | 13.01; 19.204; 20.756 77.307; 75.046; 83.226 | 4877 | Wu, Hai-Yang; Huang, Min; Qin, Chao; Wang, Xin-Long; Hu, Hai; Huang, Peng; Su, Zhong-Min Self-assembly and Li-ion storage performance of three new Nb/W mixed-addendum polyoxometalates based on the {SiNb3W9O40} clusters and transition-metal cations CrystEngComm, 2019, 21, 1862 |
7232415 | CIF | C0 H0 Cs9 K9 Mn Na0 Nb12 O199 Si4 W36 | P -1 | 12.96; 19.166; 20.622 77.511; 75.913; 83.394 | 4840 | Wu, Hai-Yang; Huang, Min; Qin, Chao; Wang, Xin-Long; Hu, Hai; Huang, Peng; Su, Zhong-Min Self-assembly and Li-ion storage performance of three new Nb/W mixed-addendum polyoxometalates based on the {SiNb3W9O40} clusters and transition-metal cations CrystEngComm, 2019, 21, 1862 |
7211120 | CIF | C0 H0 F1.5 N0 Na1.5 O5 U | C 1 2/c 1 | 15.125; 6.941; 11.257 90; 94.76; 90 | 1177.7 | Chen, Fei; Wang, Congzhi; Shi, Weiqun; Zhang, Miao; Liu, Caiming; Zhao, Yuliang; Chai, Zhifang Two new uranyl fluoride complexes with UVIO‒alkali (Na, Cs) interactions: Experimental and theoretical studies CrystEngComm, 2013, 15, 8041 |
7214002 | CIF | C0 H2 In N0 O6 P2 | R -3 :H | 9.1367; 9.1367; 25.9692 90; 90; 120 | 1877.45 | Wang, Xuelei; Yan, Yan; Wu, Junbiao; Zhang, Chuanqi; Li, Jiyang Solvothermal syntheses and structures of four indium‒phosphite coordination polymers CrystEngComm, 2014, 16, 2266 |
7214005 | CIF | C0 H7 In4 N0 O24 P7 | P -3 c 1 | 13.8148; 13.8148; 18.612 90; 90; 120 | 3076.2 | Wang, Xuelei; Yan, Yan; Wu, Junbiao; Zhang, Chuanqi; Li, Jiyang Solvothermal syntheses and structures of four indium‒phosphite coordination polymers CrystEngComm, 2014, 16, 2266 |
7246617 | CIF | C0.86 H1.71 N2.29 O0.57 | P 1 21/c 1 | 12.714; 8.0602; 7.0415 90; 95.899; 90 | 717.77 | Zhang, Jinhao; Jin, Zhiyuan; Xia, Yunlong; Li, Ying; Hao, Wenjia; Guo, Zhicheng; Wang, Ying; Peng, Rufang; Jin, Bo A π-stacking highly stable insensitive energetic inner salt and its insensitive energetic salts CrystEngComm, 2023, 25, 3181-3188 |
7229741 | CIF | C0.89 H1.19 Al0.33 N0.18 O19.12 Si8.67 | I m m m | 18.7891; 14.0936; 7.4327 90; 90; 90 | 1968.22 | Wang, Lei; Xu, Hongyi; Yan, Nana; Correll, Sascha; Xu, Shutao; Guo, Peng; Tian, Peng; Liu, Zhongmin Exploring Brønsted acids confined in the 10-ring channels of the zeolite ferrierite CrystEngComm, 2018, 20, 699 |
7214187 | CIF | C1.2 H1.4 N0.14 O0.72 S0.1 Yb0.05 | C 1 2/c 1 | 19.408; 13.692; 23.83 90; 90.937; 90 | 6332 | Zheng, Sheng-Run; Chen, Rui-Ling; Liu, Zi-Meng; Wen, Xi-Ling; Xie, Tao; Fan, Jun; Zhang, Wei-Guang Construction of terpyridine‒Ln(iii) coordination polymers: structural diversity, visible and NIR luminescence properties and response to nerve-agent mimics CrystEngComm, 2014, 16, 2898 |
7209738 | CIF | C1.5 H0.5 Cd0.25 Cl0.06 N2 O0.25 | P m -3 m | 19.362; 19.362; 19.362 90; 90; 90 | 7258.56 | Liao, Ju-Hsiou; Chen, Wan-Ting; Tsai, Cherng-Shiaw; Wang, Chih-Chieh Characterization, adsorption properties, metal ion-exchange and crystal-to-crystal transformation of Cd3[(Cd4Cl)3(BTT)8(H2O)12]2 framework, where BTT3− = 1,3,5-benzenetristetrazolate CrystEngComm, 2013, 15, 3377 |
7209739 | CIF | C1.5 H0.5 Cd0.29 Cl0.13 N2 | P m -3 m | 19.2945; 19.2945; 19.2945 90; 90; 90 | 7182.91 | Liao, Ju-Hsiou; Chen, Wan-Ting; Tsai, Cherng-Shiaw; Wang, Chih-Chieh Characterization, adsorption properties, metal ion-exchange and crystal-to-crystal transformation of Cd3[(Cd4Cl)3(BTT)8(H2O)12]2 framework, where BTT3− = 1,3,5-benzenetristetrazolate CrystEngComm, 2013, 15, 3377 |
7209740 | CIF | C1.5 H0.5 Cl0.06 Co0.29 N2 O0.25 | P m -3 m | 18.7976; 18.7976; 18.7976 90; 90; 90 | 6642.13 | Liao, Ju-Hsiou; Chen, Wan-Ting; Tsai, Cherng-Shiaw; Wang, Chih-Chieh Characterization, adsorption properties, metal ion-exchange and crystal-to-crystal transformation of Cd3[(Cd4Cl)3(BTT)8(H2O)12]2 framework, where BTT3− = 1,3,5-benzenetristetrazolate CrystEngComm, 2013, 15, 3377 |
7209743 | CIF | C1.5 H0.5 Cl0.1 N2 Ni0.42 O0.38 | P m -3 m | 18.5564; 18.5564; 18.5564 90; 90; 90 | 6389.71 | Liao, Ju-Hsiou; Chen, Wan-Ting; Tsai, Cherng-Shiaw; Wang, Chih-Chieh Characterization, adsorption properties, metal ion-exchange and crystal-to-crystal transformation of Cd3[(Cd4Cl)3(BTT)8(H2O)12]2 framework, where BTT3− = 1,3,5-benzenetristetrazolate CrystEngComm, 2013, 15, 3377 |
7209742 | CIF | C1.5 H0.5 Cl0.13 N2 Ni0.31 O0.25 | P m -3 m | 18.6483; 18.6483; 18.6483 90; 90; 90 | 6485.12 | Liao, Ju-Hsiou; Chen, Wan-Ting; Tsai, Cherng-Shiaw; Wang, Chih-Chieh Characterization, adsorption properties, metal ion-exchange and crystal-to-crystal transformation of Cd3[(Cd4Cl)3(BTT)8(H2O)12]2 framework, where BTT3− = 1,3,5-benzenetristetrazolate CrystEngComm, 2013, 15, 3377 |
7209741 | CIF | C1.5 H0.5 Cl0.19 Co0.31 N2 | P m -3 m | 18.5015; 18.5015; 18.5015 90; 90; 90 | 6333.17 | Liao, Ju-Hsiou; Chen, Wan-Ting; Tsai, Cherng-Shiaw; Wang, Chih-Chieh Characterization, adsorption properties, metal ion-exchange and crystal-to-crystal transformation of Cd3[(Cd4Cl)3(BTT)8(H2O)12]2 framework, where BTT3− = 1,3,5-benzenetristetrazolate CrystEngComm, 2013, 15, 3377 |
7208332 | CIF | C1.5 H6 As5 N S8 | F d d d :2 | 14.07; 15.3; 27.431 90; 90; 90 | 5905 | Du, Ke-Zhao; Feng, Mei-Ling; Li, Jian-Rong; Huang, Xiao-Ying pH-induced solvothermal synthesis and characterization of two novel thioarsenate compounds: Three-dimensional (1,2-pdaH2)0.5As5S8 containing ψ-As(iii)S4 and two-dimensional (NH4)2As8S13 CrystEngComm, 2012, 14, 4959 |
7229740 | CIF | C1.68 H1.9 Al0.17 N0.34 Na0.17 O9 Si4.33 | I m m m | 18.8501; 14.1221; 7.4387 90; 90; 90 | 1980.2 | Wang, Lei; Xu, Hongyi; Yan, Nana; Correll, Sascha; Xu, Shutao; Guo, Peng; Tian, Peng; Liu, Zhongmin Exploring Brønsted acids confined in the 10-ring channels of the zeolite ferrierite CrystEngComm, 2018, 20, 699 |
7215920 | CIF | C10 Br3 N6 O4 | P -1 | 6.0904; 10.3943; 13.5423 73.19; 79.7; 78.31 | 797 | Chakraborty, Shaunak; Ganguly, Somnath; Desiraju, Gautam R. Synthon transferability probed with IR spectroscopy: cytosine salts as models for salts of lamivudine CrystEngComm, 2014, 16, 4732 |
7248441 | CIF | C10 F18 | P -1 | 5.7433; 7.1269; 9.2269 111.701; 89.034; 111.392 | 323.68 | Paska, Bartłomiej; Cichowicz, Grzegorz; Rzepiński, Patryk; Cyrański, Michał Ksawery; Dobrzycki, Łukasz; Boese, Roland Structural chemistry of decalins and perfluorodecalins CrystEngComm, 2024 |
7248442 | CIF | C10 F18 | P -1 | 5.7891; 7.1855; 9.3 111.813; 89.307; 111.525 | 330.64 | Paska, Bartłomiej; Cichowicz, Grzegorz; Rzepiński, Patryk; Cyrański, Michał Ksawery; Dobrzycki, Łukasz; Boese, Roland Structural chemistry of decalins and perfluorodecalins CrystEngComm, 2024 |
7248443 | CIF | C10 F18 | P -1 | 5.8708; 7.2213; 9.3736 111.871; 90.014; 111.475 | 338.87 | Paska, Bartłomiej; Cichowicz, Grzegorz; Rzepiński, Patryk; Cyrański, Michał Ksawery; Dobrzycki, Łukasz; Boese, Roland Structural chemistry of decalins and perfluorodecalins CrystEngComm, 2024 |
7248444 | CIF | C10 F18 | P -1 | 5.7954; 7.1695; 9.3027 111.803; 89.4664; 111.572 | 330.1 | Paska, Bartłomiej; Cichowicz, Grzegorz; Rzepiński, Patryk; Cyrański, Michał Ksawery; Dobrzycki, Łukasz; Boese, Roland Structural chemistry of decalins and perfluorodecalins CrystEngComm, 2024 |
7248445 | CIF | C10 F18 | P -1 | 5.7499; 7.1098; 9.2311 111.689; 89.194; 111.435 | 323.19 | Paska, Bartłomiej; Cichowicz, Grzegorz; Rzepiński, Patryk; Cyrański, Michał Ksawery; Dobrzycki, Łukasz; Boese, Roland Structural chemistry of decalins and perfluorodecalins CrystEngComm, 2024 |
7248446 | CIF | C10 F18 | P -1 | 5.94; 7.257; 9.19 111.733; 89.911; 113.546 | 332.33 | Paska, Bartłomiej; Cichowicz, Grzegorz; Rzepiński, Patryk; Cyrański, Michał Ksawery; Dobrzycki, Łukasz; Boese, Roland Structural chemistry of decalins and perfluorodecalins CrystEngComm, 2024 |
7248450 | CIF | C10 F18 | C 1 2/c 1 | 17.1772; 6.2586; 13.1557 90; 106.43; 90 | 1356.56 | Paska, Bartłomiej; Cichowicz, Grzegorz; Rzepiński, Patryk; Cyrański, Michał Ksawery; Dobrzycki, Łukasz; Boese, Roland Structural chemistry of decalins and perfluorodecalins CrystEngComm, 2024 |
7248453 | CIF | C10 F18 | P -1 | 6.0143; 7.3233; 9.274 111.955; 90.006; 113.796 | 341.11 | Paska, Bartłomiej; Cichowicz, Grzegorz; Rzepiński, Patryk; Cyrański, Michał Ksawery; Dobrzycki, Łukasz; Boese, Roland Structural chemistry of decalins and perfluorodecalins CrystEngComm, 2024 |
7248455 | CIF | C10 F18 | C 1 2/c 1 | 17.0062; 6.2091; 13.0007 90; 105.502; 90 | 1322.85 | Paska, Bartłomiej; Cichowicz, Grzegorz; Rzepiński, Patryk; Cyrański, Michał Ksawery; Dobrzycki, Łukasz; Boese, Roland Structural chemistry of decalins and perfluorodecalins CrystEngComm, 2024 |
7248005 | CIF | C10 F6 I2 | C 1 c 1 | 43.551; 4.45154; 11.3608 90; 90.067; 90 | 2202.51 | Ohtsuka, Naoya; Ota, Hino; Sugiura, Satoshi; Kakinuma, Shuya; Sugiyama, Haruki; Suzuki, Toshiyasu; Momiyama, Norie Perfluorohalogenated naphthalenes: synthesis, crystal structure, and intermolecular interaction CrystEngComm, 2024, 26, 764-772 |
7248006 | CIF | C10 F6 I2 | P 1 21/c 1 | 10.2667; 6.0444; 8.9912 90; 94.075; 90 | 556.55 | Ohtsuka, Naoya; Ota, Hino; Sugiura, Satoshi; Kakinuma, Shuya; Sugiyama, Haruki; Suzuki, Toshiyasu; Momiyama, Norie Perfluorohalogenated naphthalenes: synthesis, crystal structure, and intermolecular interaction CrystEngComm, 2024, 26, 764-772 |
7232457 | CIF | C10 H10 Ag2 N6 O6 | P 1 21/n 1 | 9.8391; 6.9334; 10.9235 90; 103.517; 90 | 724.54 | Baudron, Stéphane A.; Chevreau, Hubert Revisiting Ag‒π interactions with bis((pyrrol-2-yl)methylene)hydrazine: CC versus CN bond complexation CrystEngComm, 2019, 21, 1853 |
7203782 | CIF | C10 H10 Au Br4 Cl I2 N2 | P c c a | 16.113; 4.2049; 28.34 90; 90; 90 | 1920.1 | Zordan, Fiorenzo; Purver, Stephen L.; Adams, Harry; Brammer, Lee Halometallate and halide ions: nucleophiles in competition for hydrogen bond and halogen bond formation in halopyridinium salts of mixed halide‒halometallate anions CrystEngComm, 2005, 7, 350 |
7231705 | CIF | C10 H10 Bi Br2 Cl5 N2 | P 1 21/c 1 | 5.5707; 15.775; 10.517 90; 104.307; 90 | 895.55 | Adonin, Sergey A.; Gorokh, Igor D.; Novikov, Alexander S.; Samsonenko, Denis G.; Yushina, Irina V.; Sokolov, Maxim N.; Fedin, Vladimir P. Halobismuthates with halopyridinium cations: appearance or non-appearance of unusual colouring CrystEngComm, 2018, 20, 7766 |
7231703 | CIF | C10 H10 Bi Br7 N2 | P -1 | 9.1733; 10.5445; 10.733 100.26; 97.127; 108.312 | 951.67 | Adonin, Sergey A.; Gorokh, Igor D.; Novikov, Alexander S.; Samsonenko, Denis G.; Yushina, Irina V.; Sokolov, Maxim N.; Fedin, Vladimir P. Halobismuthates with halopyridinium cations: appearance or non-appearance of unusual colouring CrystEngComm, 2018, 20, 7766 |
7232015 | CIF | C10 H10 Br11 N2 Sb | P 1 21/c 1 | 7.3255; 20.6666; 16.5665 90; 95.627; 90 | 2496 | Adonin, Sergey A.; Bondarenko, Mikhail A.; Novikov, Alexander S.; Abramov, Pavel A.; Plyusnin, Pavel E.; Sokolov, Maxim N.; Fedin, Vladimir P. Halogen bonding-assisted assembly of bromoantimonate(v) and polybromide-bromoantimonate-based frameworks CrystEngComm, 2019, 21, 850 |
7216316 | CIF | C10 H10 Br2 Cd N2 | P n n m | 8.649; 18.159; 3.9182 90; 90; 90 | 615.4 | Hu, Chunhua; Li, Qi; Englert, Ulli Structural trends in one and two dimensional coordination polymers of cadmium(ii) with halide bridges and pyridine-type ligands CrystEngComm, 2003, 5, 519 |
7209519 | CIF | C10 H10 Br2 Cl3 N3 O5 U | P 1 21/m 1 | 9.739; 16.484; 12.95 90; 102.36; 90 | 2030.8 | Andrews, Michael B.; Cahill, Christopher L. Metal‒organic hybrids involving the [UO2Cl3(NO3)]2− tecton and the role of halogen polarizability CrystEngComm, 2013, 15, 3082 |
7204742 | CIF | C10 H10 Br2 Cl4 Co N2 | P -1 | 6.8163; 8.9754; 13.7869 86.386; 85.454; 86.873 | 838.1 | Lee Brammer; Guillermo Mínguez Espallargas; Harry Adams Involving metals in halogen‒halogen interactions: second-sphere Lewis acid ligands for perhalometallate ions (M‒XX'‒C) CrystEngComm, 2003, 5, 343-345 |
7203324 | CIF | C10 H10 Br2 Cl6 N2 Pt | P 1 21/c 1 | 8.5802; 16.7418; 7.0007 90; 112.504; 90 | 929.06 | Fiorenzo Zordan; Guillermo Mínguez Espallargas; Lee Brammer Unexpected structural homologies involving hydrogen-bonded and halogen-bonded networks in halopyridinium halometallate salts CrystEngComm, 2006, 8, 425 |
7232421 | CIF | C10 H10 Br2 Cu N6 O2 | P -1 | 3.797; 6.8449; 13.71 104.357; 90.019; 92.757 | 344.77 | Hearne, Neil; Turnbull, Mark M.; Landee, Christopher P.; van der Merwe, Elizabet M.; Rademeyer, Melanie Halide-bi-bridged polymers of amide substituted pyridines and -pyrazines: polymorphism, structures, thermal stability and magnetism CrystEngComm, 2019, 21, 1910 |
7226589 | CIF | C10 H10 Br2 I4 N2 Pb | P 1 21/c 1 | 12.1436; 8.7824; 9.4776 90; 99.676; 90 | 996.41 | Gómez, Verónica; Fuhr, Olaf; Ruben, Mario Structural diversity in substituted-pyridinium iodo- and bromoplumbates: a matter of halide and temperature CrystEngComm, 2016, 18, 8207 |
7224725 | CIF | C10 H10 Br2 N2 | P -1 | 4.8986; 7.6614; 7.989 70.464; 87.005; 77.176 | 275.44 | Anioła, Michalina; Katrusiak, Andrzej Pressure-preferred symmetric reactions of 4,4′-bipyridine hydrobromide CrystEngComm, 2016, 18, 3223 |
7224726 | CIF | C10 H10 Br2 N2 | P -1 | 4.8839; 7.622; 7.951 70.87; 86.78; 77.39 | 272.8 | Anioła, Michalina; Katrusiak, Andrzej Pressure-preferred symmetric reactions of 4,4′-bipyridine hydrobromide CrystEngComm, 2016, 18, 3223 |
7224727 | CIF | C10 H10 Br2 N2 | P -1 | 4.874; 7.567; 7.936 70.73; 86.64; 77.47 | 269.7 | Anioła, Michalina; Katrusiak, Andrzej Pressure-preferred symmetric reactions of 4,4′-bipyridine hydrobromide CrystEngComm, 2016, 18, 3223 |
7224728 | CIF | C10 H10 Br2 N2 | P -1 | 4.845; 7.453; 7.875 70.89; 86.82; 77.82 | 262.6 | Anioła, Michalina; Katrusiak, Andrzej Pressure-preferred symmetric reactions of 4,4′-bipyridine hydrobromide CrystEngComm, 2016, 18, 3223 |
7224729 | CIF | C10 H10 Br2 N2 | P -1 | 4.8011; 7.275; 7.759 71.06; 86.46; 78.64 | 251.3 | Anioła, Michalina; Katrusiak, Andrzej Pressure-preferred symmetric reactions of 4,4′-bipyridine hydrobromide CrystEngComm, 2016, 18, 3223 |
7210570 | CIF | C10 H10 Br2 N6 O Zn | P b c a | 10.135; 13.562; 20.655 90; 90; 90 | 2839 | Yang, Pan; Wu, Xiang Xia; Huo, Jian Zhong; Ding, Bin; Wang, Ying; Wang, XiuGuang Hydrothermal synthesis and characterization of a series of luminescent Zn(ii) and Cd(ii) coordination polymers with the new versatile multidentate ligand 1,3-di-(1,2,4-triazol-4-yl)benzene CrystEngComm, 2013, 15, 8097 |
7206073 | CIF | C10 H10 Br6 Cu N2 | P -1 | 6.58904; 8.60622; 16.25227 89.7895; 89.4785; 79.0643 | 904.84 | Mínguez Espallargas, Guillermo; Florence, Alastair J.; van de Streek, Jacco; Brammer, Lee Different structural destinations: comparing reactions of [CuBr2(3-Brpy)2] crystals with HBr and HCl gas CrystEngComm, 2011, 13, 4400 |
7206074 | CIF | C10 H10 Br6 Cu N2 | P -1 | 6.585083; 8.604378; 16.26256 89.7706; 89.4765; 79.1189 | 904.839 | Mínguez Espallargas, Guillermo; Florence, Alastair J.; van de Streek, Jacco; Brammer, Lee Different structural destinations: comparing reactions of [CuBr2(3-Brpy)2] crystals with HBr and HCl gas CrystEngComm, 2011, 13, 4400 |
7226597 | CIF | C10 H10 Br6 N2 Pb | P n m a | 8.2011; 24.015; 9.0459 90; 90; 90 | 1781.6 | Gómez, Verónica; Fuhr, Olaf; Ruben, Mario Structural diversity in substituted-pyridinium iodo- and bromoplumbates: a matter of halide and temperature CrystEngComm, 2016, 18, 8207 |
7232018 | CIF | C10 H10 Br9 I2 N2 Sb | P 1 21/n 1 | 8.18; 12.9394; 12.5865 90; 105.412; 90 | 1284.3 | Adonin, Sergey A.; Bondarenko, Mikhail A.; Novikov, Alexander S.; Abramov, Pavel A.; Plyusnin, Pavel E.; Sokolov, Maxim N.; Fedin, Vladimir P. Halogen bonding-assisted assembly of bromoantimonate(v) and polybromide-bromoantimonate-based frameworks CrystEngComm, 2019, 21, 850 |
7214255 | CIF | C10 H10 Cd Cl2 N10 O0 | P 1 21/c 1 | 3.694; 8.184; 23.62 90; 94.49; 90 | 711.9 | Song, Yuna; Yin, Xinbo; Tu, Binbin; Pang, Qingqing; Li, Haiwei; Ren, Xiaoqian; Wang, Bo; Li, Qiaowei Metal‒organic frameworks constructed from mixed infinite inorganic units and adenine CrystEngComm, 2014, 16, 3082 |
7216315 | CIF | C10 H10 Cd Cl2 N2 | P 1 21/n 1 | 3.8233; 8.6525; 17.748 90; 91.562; 90 | 586.91 | Hu, Chunhua; Li, Qi; Englert, Ulli Structural trends in one and two dimensional coordination polymers of cadmium(ii) with halide bridges and pyridine-type ligands CrystEngComm, 2003, 5, 519 |
7217326 | CIF | C10 H10 Cd Cl4 N6 | P 1 21/n 1 | 7.478; 26.697; 8.27 90; 96.55; 90 | 1640.2 | Orvay, Francisca; Bauzá, Antonio; Barceló-Oliver, Miquel; García-Raso, Angel; Fiol, Joan J.; Costa, Antoni; Molins, Elies; Mata, Ignasi; Frontera, Antonio Synthesis, X-ray characterization and DFT studies of bis-N-imidazolylpyrimidine salts: the prominent role of hydrogen bonding and anion‒π interactions CrystEngComm, 2014, 16, 9043 |
7216317 | CIF | C10 H10 Cd I2 N2 | P b c a | 8.848; 17.79; 18.666 90; 90; 90 | 2938 | Hu, Chunhua; Li, Qi; Englert, Ulli Structural trends in one and two dimensional coordination polymers of cadmium(ii) with halide bridges and pyridine-type ligands CrystEngComm, 2003, 5, 519 |
7216318 | CIF | C10 H10 Cd I2 N2 | P b c a | 8.7603; 17.436; 18.581 90; 90; 90 | 2838.1 | Hu, Chunhua; Li, Qi; Englert, Ulli Structural trends in one and two dimensional coordination polymers of cadmium(ii) with halide bridges and pyridine-type ligands CrystEngComm, 2003, 5, 519 |
7240500 | CIF | C10 H10 Cl I3 N2 | P -1 | 8.2027; 8.8661; 11.48 89.566; 70.547; 81.668 | 778.18 | Fotović, Luka; Stilinovic, Vladimir Halogenide anions as halogen and hydrogen bond acceptors in iodopyridinium halogenides CrystEngComm, 2020 |
7232057 | CIF | C10 H10 Cl N3 O3 | P 21 21 21 | 4.669; 8.554; 28.15 90; 90; 90 | 1124 | Wenholz, Daniel S.; Bhadbhade, Mohan; Kandemir, Hakan; Ho, Junming; Kumar, Naresh; Black, David StC. Substituent effects in solid-state assembly of activated benzotriazoles CrystEngComm, 2019, 21, 835 |
7223178 | CIF | C10 H10 Cl N3 O3 Zn | P 1 21/c 1 | 9.097; 17.622; 7.464 90; 92.337; 90 | 1195.5 | Yang, Li-Bo; Wang, Hong-Can; Fang, Xiao-Dan; Chen, Si-Jin; Xu, Quan-Qing; Zhu, Ai-Xin; Yang, Zhi A series of Zn(ii) and Cd(ii) coordination compounds based on 4-(4H-1,2,4-triazol-4-yl)benzoic acid: synthesis, structure and photoluminescence properties CrystEngComm, 2016, 18, 130 |
7203323 | CIF | C10 H10 Cl10 Cu3 N2 | P -1 | 3.8783; 11.217; 12.564 103.511; 93.34; 99.507 | 521.5 | Fiorenzo Zordan; Guillermo Mínguez Espallargas; Lee Brammer Unexpected structural homologies involving hydrogen-bonded and halogen-bonded networks in halopyridinium halometallate salts CrystEngComm, 2006, 8, 425 |
7232423 | CIF | C10 H10 Cl2 Cu N6 O2 | P -1 | 3.661; 6.626; 13.7328 76.315; 89.743; 85.572 | 322.67 | Hearne, Neil; Turnbull, Mark M.; Landee, Christopher P.; van der Merwe, Elizabet M.; Rademeyer, Melanie Halide-bi-bridged polymers of amide substituted pyridines and -pyrazines: polymorphism, structures, thermal stability and magnetism CrystEngComm, 2019, 21, 1910 |
7221661 | CIF | C10 H10 Cl2 Hg N2 O2 | P 1 2/c 1 | 14.897; 10.377; 8.216 90; 90.647; 90 | 1270 | Zhang, Zhong; Feng, Yan-Fang; Wei, Qiu-Yu; Hu, Kun; Chen, Zi-Lu; Liang, Fu-Pei Metal-controlled structural variations of coordination architectures constructed from flexible 1H-benzimidazole-1-propionic acid CrystEngComm, 2015, 17, 6724 |
7246397 | CIF | C10 H10 Cl2 N2 O6 S2 | P -1 | 7.754; 9.591; 11.88 85.36; 80.05; 70.72 | 821.1 | Kar, Ananya; Giri, Lopamudra; Kenguva, Gowtham; Rout, Smruti Rekha; Dandela, Rambabu Exploration and investigation of various solid forms of an anti-glaucoma drug – dichlorphenamide CrystEngComm, 2023, 25, 1874-1883 |
7218903 | CIF | C10 H10 Cl2 N6 O | P -1 | 7.3765; 7.5213; 12.1712 97.744; 92.657; 110.303 | 624.38 | Seth, Saikat Kumar; Lee, Vannajan Sanghiran; Yana, Janchai; Zain, Sharifuddin M.; Cunha, Anna C.; Ferreira, Vitor F.; Jordão, Alessandro K.; de Souza, Maria C. B. V.; Wardell, Solange M. S. V.; Wardell, James L.; Tiekink, Edward R. T. Crystallographic and computational study of 1-(arylamino)-1,2,3-triazole-4-carbohydrazides CrystEngComm, 2015, 17, 2255 |
7204743 | CIF | C10 H10 Cl4 Co I2 N2 | P 1 21/c 1 | 6.983; 16.1749; 15.7849 90; 96.306; 90 | 1772.1 | Lee Brammer; Guillermo Mínguez Espallargas; Harry Adams Involving metals in halogen‒halogen interactions: second-sphere Lewis acid ligands for perhalometallate ions (M‒XX'‒C) CrystEngComm, 2003, 5, 343-345 |
7212862 | CIF | C10 H10 Cl4 Co0.05 N2 Zn0.95 | P 1 21/c 1 | 7.6491; 19.7209; 9.4569 90; 109.049; 90 | 1348.43 | Adams, Christopher J.; Gillon, Amy L.; Lusi, Matteo; Orpen, A. Guy Towards polymorphism control in coordination networks and metallo-organic salts CrystEngComm, 2010, 12, 4403 |
7212863 | CIF | C10 H10 Cl4 Co0.07 N2 Zn0.93 | P 1 21/c 1 | 7.6596; 19.7388; 9.4616 90; 109.062; 90 | 1352.07 | Adams, Christopher J.; Gillon, Amy L.; Lusi, Matteo; Orpen, A. Guy Towards polymorphism control in coordination networks and metallo-organic salts CrystEngComm, 2010, 12, 4403 |
7212861 | CIF | C10 H10 Cl4 Co0.14 N2 Zn0.86 | P 1 21/c 1 | 7.6596; 19.7497; 9.4708 90; 109.067; 90 | 1354.09 | Adams, Christopher J.; Gillon, Amy L.; Lusi, Matteo; Orpen, A. Guy Towards polymorphism control in coordination networks and metallo-organic salts CrystEngComm, 2010, 12, 4403 |
7217324 | CIF | C10 H10 Cl4 Hg N6 | P 1 21/n 1 | 7.54; 26.67; 8.2 90; 97.002; 90 | 1636.7 | Orvay, Francisca; Bauzá, Antonio; Barceló-Oliver, Miquel; García-Raso, Angel; Fiol, Joan J.; Costa, Antoni; Molins, Elies; Mata, Ignasi; Frontera, Antonio Synthesis, X-ray characterization and DFT studies of bis-N-imidazolylpyrimidine salts: the prominent role of hydrogen bonding and anion‒π interactions CrystEngComm, 2014, 16, 9043 |
7201429 | CIF | C10 H10 Cl4 N2 O2 U | P -1 | 5.567; 8.5723; 8.8394 71.139; 73.078; 86.534 | 381.64 | Deifel, Nicholas P.; Cahill, Christopher L. The uranyl tetrachloride anion as a tecton in the assembly of U(VI) hybrid materials CrystEngComm, 2009, 11, 2739 |
7215589 | CIF | C10 H10 Cl4 N2 O2 U | P -1 | 8.968; 9.9186; 10.4833 66.002; 87.096; 64.555 | 760.5 | Deifel, Nicholas P.; Cahill, Christopher L. The uranyl tetrachloride anion as a tecton in the assembly of U(VI) hybrid materials CrystEngComm, 2009, 11, 2739 |
7215590 | CIF | C10 H10 Cl4 N2 O2 U | P -1 | 8.9215; 9.8582; 10.3689 65.72; 86.22; 64.64 | 744.42 | Deifel, Nicholas P.; Cahill, Christopher L. The uranyl tetrachloride anion as a tecton in the assembly of U(VI) hybrid materials CrystEngComm, 2009, 11, 2739 |
7217328 | CIF | C10 H10 Cl4 N6 Zn | C c m 21 | 11.395; 14.021; 10.265 90; 90; 90 | 1640 | Orvay, Francisca; Bauzá, Antonio; Barceló-Oliver, Miquel; García-Raso, Angel; Fiol, Joan J.; Costa, Antoni; Molins, Elies; Mata, Ignasi; Frontera, Antonio Synthesis, X-ray characterization and DFT studies of bis-N-imidazolylpyrimidine salts: the prominent role of hydrogen bonding and anion‒π interactions CrystEngComm, 2014, 16, 9043 |
7209518 | CIF | C10 H10 Cl5 N3 O5 U | P -1 | 6.819; 10.781; 14.252 72.89; 80.394; 74.456 | 960.3 | Andrews, Michael B.; Cahill, Christopher L. Metal‒organic hybrids involving the [UO2Cl3(NO3)]2− tecton and the role of halogen polarizability CrystEngComm, 2013, 15, 3082 |
7204741 | CIF | C10 H10 Cl6 Co N2 | P -1 | 6.7526; 8.1793; 14.806 92.114; 93.148; 99.358 | 804.8 | Lee Brammer; Guillermo Mínguez Espallargas; Harry Adams Involving metals in halogen‒halogen interactions: second-sphere Lewis acid ligands for perhalometallate ions (M‒XX'‒C) CrystEngComm, 2003, 5, 343-345 |
7205678 | CIF | C10 H10 Cl6 Cu N2 | P 1 21/c 1 | 7.5585; 27.376; 8.7184 90; 115.492; 90 | 1628.39 | Vitorica-Yrezabal, Iñigo J.; Sullivan, Rachel A.; Purver, Stephen L.; Curfs, Caroline; Tang, Chiu C.; Brammer, Lee Synthesis and polymorphism of (4-ClpyH)2[CuCl4]: solid‒gas and solid‒solid reactions CrystEngComm, 2011, 13, 3189 |
7205679 | CIF | C10 H10 Cl6 Cu N2 | P 1 21/c 1 | 7.578; 27.411; 8.7224 90; 115.57; 90 | 1634.4 | Vitorica-Yrezabal, Iñigo J.; Sullivan, Rachel A.; Purver, Stephen L.; Curfs, Caroline; Tang, Chiu C.; Brammer, Lee Synthesis and polymorphism of (4-ClpyH)2[CuCl4]: solid‒gas and solid‒solid reactions CrystEngComm, 2011, 13, 3189 |
7205680 | CIF | C10 H10 Cl6 Cu N2 | C 1 2/c 1 | 16.263; 7.3876; 13.645 90; 99.33; 90 | 1617.7 | Vitorica-Yrezabal, Iñigo J.; Sullivan, Rachel A.; Purver, Stephen L.; Curfs, Caroline; Tang, Chiu C.; Brammer, Lee Synthesis and polymorphism of (4-ClpyH)2[CuCl4]: solid‒gas and solid‒solid reactions CrystEngComm, 2011, 13, 3189 |
7203322 | CIF | C10 H10 Cl6 N2 Pd | P -1 | 6.9605; 7.3662; 8.6496 113.41; 91.97; 98.06 | 400.98 | Fiorenzo Zordan; Guillermo Mínguez Espallargas; Lee Brammer Unexpected structural homologies involving hydrogen-bonded and halogen-bonded networks in halopyridinium halometallate salts CrystEngComm, 2006, 8, 425 |
7221061 | CIF | C10 H10 Cr Gd N2 O12 | P 42/m b c | 10.8092; 10.8092; 12.501 90; 90; 90 | 1460.6 | Liu, Sui-Jun; Xie, Xin-Rong; Zheng, Teng-Fei; Bao, Jun; Liao, Jin-Sheng; Chen, Jing-Lin; Wen, He-Rui Three-dimensional two-fold interpenetrated CrIII‒GdIIIheterometallic framework as an attractive cryogenic magnetorefrigerant CrystEngComm, 2015, 17, 7270 |
7244475 | CIF | C10 H10 Cu F N O4 | P b c a | 7.6004; 14.1706; 20.2294 90; 90; 90 | 2178.75 | Li, Zhongkui; Su, Hao; Zhu, Yanhong; Yan, Li; Li, Hui Structural transformation of copper coordination complexes accompanied with chiral transformation CrystEngComm, 2022 |
7219778 | CIF | C10 H10 Cu K2 O12 | P -1 | 7.7391; 10.6004; 10.6159 112.867; 90.411; 104.192 | 772.8 | Clegg, William; Holcroft, James M.; Martin, Nicola C. Copper pyromellitates: a complex story CrystEngComm, 2015, 17, 2857 |
7219779 | CIF | C10 H10 Cu Na2 O12 | C 1 2/c 1 | 6.894; 16.3377; 12.9381 90; 99.666; 90 | 1436.56 | Clegg, William; Holcroft, James M.; Martin, Nicola C. Copper pyromellitates: a complex story CrystEngComm, 2015, 17, 2857 |
7248103 | CIF | C10 H10 Cu2 I6 N4 | P 1 21/n 1 | 11.0164; 15.4161; 12.9223 90; 103.359; 90 | 2135.21 | Zaguzin, Alexander S.; Zaitsev, Artem V.; Korobeynikov, Nikita A.; Novikov, Alexander S.; Usoltsev, Andrey N.; Fedin, Vladimir P.; Adonin, Sergey A. 4,5-Diiodo-1-H-imidazole-derived linker ligand and Cu(i) and Co(ii) coordination polymers based thereupon CrystEngComm, 2024, 26, 1607-1612 |
7207237 | CIF | C10 H10 Cu2 N6 O6 | P 1 21/a 1 | 14.897; 5.819; 17.441 90; 107.581; 90 | 1441.3 | Maekawa, Masahiko; Tominaga, Toshi; Sugimoto, Kunihisa; Okubo, Takashi; Kuroda-Sowa, Takayoshi; Munakata, Megumu; Kitagawa, Susumu Framework dimensionality of copper(i) coordination polymers of 4,4′-bipyrimidine controlled by anions and solvents CrystEngComm, 2012, 14, 1345 |
7209854 | CIF | C10 H10 Cu3 I2 N4 O6 | P b c n | 7.6664; 31.951; 15.481 90; 90; 90 | 3792.1 | Wen, Zhen-Zhen; Wen, Xi-Ling; Cai, Song-Liang; Zheng, Sheng-Run; Fan, Jun; Zhang, Wei-Guang The construction of Cu(i)/Cu(ii) coordination polymers based on pyrazine‒carboxylate: Structural diversity tuned by in situ hydrolysis reaction CrystEngComm, 2013, 15, 5359 |
7240005 | CIF | C10 H10 F N O3 S | P -1 | 8.2627; 8.335; 8.7473 91.177; 117.067; 97.41 | 529.82 | Mondal, Pradip Kumar; Bhandary, Subhrajyoti; Javoor, Manjunath G.; Cleetus, Annie; Mangalampalli, S. R. N. Kiran; Ramamurty, Upadrasta; Chopra, Deepak Probing the distinct nanomechanical behaviour of a new co-crystal and a known solvate of 5-fluoroisatin and identification of a new polymorph CrystEngComm, 2020, 22, 2566-2572 |
7214065 | CIF | C10 H10 F3 N O2 S | P 21 21 21 | 4.3006; 12.286; 21.406 90; 90; 90 | 1131 | Clark, Ewan R.; Hayward, John J.; Leontowicz, Bryce J.; Eisler, Dana J.; Rawson, Jeremy M. Syntheses of, and structural studies on, benzo-fused 1,2,4-thiadiazines CrystEngComm, 2014, 16, 1755 |
7205055 | CIF | C10 H10 Hg1.5 N15 O2 | P 1 21/c 1 | 7.2819; 17.4904; 14.8161 90; 115.224; 90 | 1707.1 | Yang, En-Cui; Feng, Yan; Liu, Zhong-Yi; Liu, Tian-Yu; Zhao, Xiao-Jun Diverse mixed-ligand metal complexes with in situ generated 5-(pyrazinyl)tetrazolate chelating-bridging ligand: in situ synthesis, crystal structures, magnetic and luminescent properties CrystEngComm, 2011, 13, 230 |
7210145 | CIF | C10 H10 Ho N2 O9 | P -1 | 6.482; 9.848; 10.907 100.004; 106.484; 106.293 | 616.1 | Wang, Ping; Fan, Rui-Qing; Yang, Yu-Lin; Liu, Xin-Rong; Xiao, Peng; Li, Xin-Yu; Hasi, Wuliji; Cao, Wen-Wu 1-D helical chain, 2-D layered network and 3-D porous lanthanide‒organic frameworks based on multiple coordination sites of benzimidazole-5,6-dicarboxylic acid: synthesis, crystal structure, photoluminescence and thermal stability CrystEngComm, 2013, 15, 4489 |
7248102 | CIF | C10 H10 I4 N4 | P b c a | 8.7171; 12.9296; 14.2643 90; 90; 90 | 1607.71 | Zaguzin, Alexander S.; Zaitsev, Artem V.; Korobeynikov, Nikita A.; Novikov, Alexander S.; Usoltsev, Andrey N.; Fedin, Vladimir P.; Adonin, Sergey A. 4,5-Diiodo-1-H-imidazole-derived linker ligand and Cu(i) and Co(ii) coordination polymers based thereupon CrystEngComm, 2024, 26, 1607-1612 |
7214223 | CIF | C10 H10 Mn O5 | P b c a | 9.2037; 7.9073; 29.7366 90; 90; 90 | 2164.12 | Déniz, Mariadel; Hernández-Rodríguez, Irene; Pasán, Jorge; Fabelo, Oscar; Cañadillas-Delgado, Laura; Vallejo, Julia; Julve, Miguel; Lloret, Francesc; Ruiz-Pérez, Catalina Syntheses, crystal structures and magnetic properties of five new manganese(ii) complexes: influence of the conformation of different alkyl/aryl substituted malonate ligands on the crystal packing CrystEngComm, 2014, 16, 2766 |
7224628 | CIF | C10 H10 N O2 S | P 43 21 2 | 8.3899; 8.3899; 27.226 90; 90; 90 | 1916.4 | Sivakumar, Reajean; Askari, Mohammad S.; Woo, Simon; Madwar, Carolin; Ottenwaelder, Xavier; Bohle, D. Scott; Cuccia, Louis A. Homochiral crystal generation via sequential dehydration and Viedma ripening CrystEngComm, 2016, 18, 4277 |
7238495 | CIF | C10 H10 N O3 | C 1 2/c 1 | 10.875; 13.254; 14.054 90; 109.04; 90 | 1914.9 | Luo, Yang-Hui; Zhang, Chen-Guang; Xu, Bing; Sun, Bai-Wang A cocrystal strategy for the precipitation of liquid 2,3-dimethyl pyrazine with hydroxyl substituted benzoic acid and a Hirshfeld surfaces analysis of them CrystEngComm, 2012, 14, 6860 |
7220821 | CIF | C10 H10 N O5 Zn | P 1 2/c 1 | 5.8438; 12.088; 15.288 90; 99.975; 90 | 1063.6 | Bello, Lizaira; Quintero, Marilyn; Mora, Asiloé J.; González, Teresa; Escalona, Ana; Añez, Rafael; Ávila, Edward E.; Briceño, Alexander Study of temperature and ligand flexibility effects on coordination polymer formation from cyclobutanetetracarboxylic acid CrystEngComm, 2015, 17, 5921 |
7219639 | CIF | C10 H10 N2 | P 1 21/c 1 | 5.2162; 12.3693; 13.1192 90; 99.065; 90 | 835.89 | Braun, Doris E.; Gelbrich, Thomas; Kahlenberg, Volker; Griesser, Ulrich J. Solid state forms of 4-aminoquinaldine - From void structures with and without solvent inclusion to close packing. CrystEngComm / RSC, 2015, 17, 2504-2516 |
7238342 | CIF | C10 H10 N2 | F d d 2 | 13.4667; 19.3913; 6.3165 90; 90; 90 | 1649.47 | Bailey, Andrew James; Horton, Peter Neil; Grossel, Martin Christopher Self-assembly into infinite tapes by 2,7-disubstituted-1,8-naphthyridines in the solid state CrystEngComm, 2010, 12, 4074 |
7212316 | CIF | C10 H10 N2 O S | C 1 2/c 1 | 21.947; 8.5282; 11.4242 90; 115.115; 90 | 1936.1 | Jha, Sushil; Silversides, Jon D.; Boyle, Ross W.; Archibald, Stephen J. Hydrogen bonded dimers vs. one-dimensional chains in 2-thiooxoimidazolidin-4-one (thiohydantoin) drug derivatives CrystEngComm, 2010, 12, 1730 |
7241485 | CIF | C10 H10 N2 O S | P 1 21/n 1 | 8.4215; 14.1614; 8.8819 90; 108.134; 90 | 1006.65 | Tan, Davin; Ng, Zi Xuan; Ganguly, Rakesh; Li, Yongxin; Soo, Han Sen; Mohamed, Sharmarke; García, Felipe Investigating the solid-state assembly of pharmaceutically-relevant N,N-dimethyl-O-thiocarbamates in the absence of labile hydrogen bonds CrystEngComm, 2020 |
7230563 | CIF | C10 H10 N2 O2 | P 1 21 1 | 7.3454; 6.2161; 10.797 90; 108.144; 90 | 468.48 | Daszkiewicz, Marek; Puszyńska-Tuszkanow, Mariola; Staszak, Zbigniew; Chojnacka, Ida; Fałtynowicz, Hanna; Cieślak-Golonka, Maria Single crystal-to-single crystal transformations induced by ammonia‒water equilibrium changes CrystEngComm, 2018, 20, 2907 |
7213571 | CIF | C10 H10 N2 O2 S | P 1 21/n 1 | 11.642; 4.6349; 18.8292 90; 95.453; 90 | 1011.42 | Khan, Imtiaz; Ibrar, Aliya; Simpson, Jim Similarities and differences in the crystal packing of methoxybenzyl and methoxyphenylethyl-1,3,4-oxadiazole-2(3H)-thiones CrystEngComm, 2014, 16, 164 |
7213572 | CIF | C10 H10 N2 O2 S | P 1 21/n 1 | 8.6916; 13.2144; 8.9458 90; 93.96; 90 | 1025.01 | Khan, Imtiaz; Ibrar, Aliya; Simpson, Jim Similarities and differences in the crystal packing of methoxybenzyl and methoxyphenylethyl-1,3,4-oxadiazole-2(3H)-thiones CrystEngComm, 2014, 16, 164 |
7213573 | CIF | C10 H10 N2 O2 S | P 1 21/n 1 | 7.5365; 5.5019; 24.9737 90; 92.956; 90 | 1034.16 | Khan, Imtiaz; Ibrar, Aliya; Simpson, Jim Similarities and differences in the crystal packing of methoxybenzyl and methoxyphenylethyl-1,3,4-oxadiazole-2(3H)-thiones CrystEngComm, 2014, 16, 164 |
7241378 | CIF | C10 H10 N2 O2 S4 | P 1 21/c 1 | 14.3245; 4.9698; 19.9041 90; 106.595; 90 | 1357.95 | Sumimoto, Yuji; Iijima, Kodai; Yoo, Dongho; Kawamoto, Tadashi; Le Gal, Yann; Lorcy, Dominique; Mori, Takehiko Structures and transistor properties of extended and unsymmetrical birhodanines CrystEngComm, 2020 |
7200288 | CIF | C10 H10 N2 O5 | P 1 21/c 1 | 5.5314; 13.7844; 14.2056 90; 92.59; 90 | 1082.03 | Karki, Shyam; Friščić, Tomislav; Jones, William Control and interconversion of cocrystal stoichiometry in grinding: stepwise mechanism for the formation of a hydrogen-bonded cocrystal CrystEngComm, 2009, 11, 470 |
7200584 | CIF | C10 H10 N2 O5 | P 1 21/c 1 | 5.55; 13.792; 14.36 90; 93.41; 90 | 1097.2 | Orola, Liana; Veidis, Mikelis V. Nicotinamide fumaric acid supramolecular cocrystals: diversity of stoichiometry CrystEngComm, 2009, 11, 415 |
7229687 | CIF | C10 H10 N2 O6 | P -1 | 7.2047; 7.5455; 10.8058 91.8; 100.509; 115.757 | 516.12 | Lombard, Jean; Loots, Leigh; le Roex, Tanya; Haynes, Delia A. Formation of multi-component crystals with a series of pyridinium-carboxyacrylate zwitterions CrystEngComm, 2018, 20, 25 |
7210144 | CIF | C10 H10 N2 O9 Tb | P -1 | 6.5059; 9.8342; 10.9444 99.882; 106.505; 106.19 | 620.36 | Wang, Ping; Fan, Rui-Qing; Yang, Yu-Lin; Liu, Xin-Rong; Xiao, Peng; Li, Xin-Yu; Hasi, Wuliji; Cao, Wen-Wu 1-D helical chain, 2-D layered network and 3-D porous lanthanide‒organic frameworks based on multiple coordination sites of benzimidazole-5,6-dicarboxylic acid: synthesis, crystal structure, photoluminescence and thermal stability CrystEngComm, 2013, 15, 4489 |
7201830 | CIF | C10 H10 N4 O | P 1 21/n 1 | 11.663; 6.008; 13.328 90; 92.231; 90 | 933.2 | Legrand, Yves-Marie; Michau, Mathieu; van der Lee, Arie; Barboiu, Mihail Homomeric and heteromeric self-assembly of hybrid ureido‒imidazole compounds CrystEngComm, 2008, 10, 490 |
7201832 | CIF | C10 H10 N4 O | P 1 21/c 1 | 11.663; 6.008; 17.365 90; 129.922; 90 | 933.2 | Legrand, Yves-Marie; Michau, Mathieu; van der Lee, Arie; Barboiu, Mihail Homomeric and heteromeric self-assembly of hybrid ureido‒imidazole compounds CrystEngComm, 2008, 10, 490 |
7225490 | CIF | C10 H10 N4 O2 | P 42/n | 19.9241; 19.9241; 5.1153 90; 90; 90 | 2030.6 | Safin, Damir A.; Robeyns, Koen; Garcia, Yann 1,2,4-Triazole-based molecular switches: crystal structures, Hirshfeld surface analysis and optical properties CrystEngComm, 2016, 18, 7284 |
7230611 | CIF | C10 H10 N4 O4 | P b c a | 7.0875; 11.9657; 24.919 90; 90; 90 | 2113.3 | Kumar, Vineet; Goswami, Pramod Kumar; Thaimattam, Ram; Ramanan, Arunachalam Multicomponent solids of uracil derivatives ‒ orotic and isoorotic acids CrystEngComm, 2018, 20, 3490 |
7230614 | CIF | C10 H10 N4 O4 | P 1 21/c 1 | 12.194; 5.1402; 17.488 90; 99.377; 90 | 1081.5 | Kumar, Vineet; Goswami, Pramod Kumar; Thaimattam, Ram; Ramanan, Arunachalam Multicomponent solids of uracil derivatives ‒ orotic and isoorotic acids CrystEngComm, 2018, 20, 3490 |
7247216 | CIF | C10 H10 N4 O4 | P 1 21/c 1 | 10.5137; 5.4852; 10.3155 90; 110.873; 90 | 555.85 | Pagliari, Anderson B.; Rosa, Jéssica M. L.; de Lima, Priscila S. V.; Zimmer, Geórgia C.; da Silva, Maria E. C.; de Oliveira, Érica G.; Bonacorso, Helio G.; Zanatta, Nilo; Martins, Marcos A. P. Polymorphism in N-(5-methylisoxazol-3-yl)malonamide: understanding the supramolecular structure and the crystallization mechanism CrystEngComm, 2023, 25, 5118-5132 |
7231179 | CIF | C10 H10 N6 Pb S3 | P 1 c 1 | 9.0368; 11.3777; 7.6503 90; 112.279; 90 | 727.87 | Seth, Saikat Kumar; Bauzá, Antonio; Mahmoudi, Ghodrat; Stilinović, Vladimir; López-Torres, Elena; Zaragoza, Guillermo; Keramidas, Anastasios D.; Frontera, Antonio On the importance of Pb⋯X (X = O, N, S, Br) tetrel bonding interactions in a series of tetra- and hexa-coordinated Pb(ii) compounds CrystEngComm, 2018, 20, 5033 |
7215926 | CIF | C10 H10 Nd2 O15 | P -1 | 8.2494; 9.311; 11.6959 79.306; 70.324; 76.048 | 815.58 | Sushrutha, S. R.; Natarajan, Srinivasan Rare-earth carboxylates, [Ln2(iii)(μ3-OH)(C4H4O5)2(C4H2O4)]·2H2O [Ln = Ce, Pr and Nd]: synthesis, structure and properties CrystEngComm, 2014, 16, 4774 |
7203060 | CIF | C10 H10 O S | P -1 | 6.7881; 7.9542; 8.7386 94.048; 92.037; 95.872 | 467.75 | Lehane, K. Niamh; Moynihan, Edmond J. A.; Brondel, Nicolas; Lawrence, Simon E.; Maguire, Anita R. Impact of sulfur substituents on the C‒H⋯O interaction of terminal alkynes in crystal engineering CrystEngComm, 2007, 9, 1041 |
7203061 | CIF | C10 H10 O2 S | P 1 21/n 1 | 10.5942; 7.9196; 11.5721 90; 98.59; 90 | 960.03 | Lehane, K. Niamh; Moynihan, Edmond J. A.; Brondel, Nicolas; Lawrence, Simon E.; Maguire, Anita R. Impact of sulfur substituents on the C‒H⋯O interaction of terminal alkynes in crystal engineering CrystEngComm, 2007, 9, 1041 |
7227192 | CIF | C10 H10 O3 | P 1 21/c 1 | 6.53; 10.411; 12.121 90; 97.062; 90 | 817.8 | Jezowski, Sebastian R.; Monaco, Stephen; Yennawar, Hemant P.; Wonderling, Nichole M.; Mathers, Robert T.; Schatschneider, Bohdan Unusual physical behaviour and polymorphic phase transitions in crystalline bicyclic anhydrides CrystEngComm, 2017, 19, 276 |
7247467 | CIF | C10 H10 O3 | P 1 21/c 1 | 15.3694; 5.216; 22.3953 90; 97.797; 90 | 1778.76 | Poręba, Tomasz; Świątkowski, Marcin; Confalonieri, Giorgia Melting pseudosymmetry and thermal expansion in 3-benzoylpropionic acid CrystEngComm, 2023, 25, 5932-5941 |
7247468 | CIF | C10 H10 O3 | P 1 21/n 1 | 12.7762; 5.23515; 14.4736 90; 111.409; 90 | 901.27 | Poręba, Tomasz; Świątkowski, Marcin; Confalonieri, Giorgia Melting pseudosymmetry and thermal expansion in 3-benzoylpropionic acid CrystEngComm, 2023, 25, 5932-5941 |
7247469 | CIF | C10 H10 O3 | P 1 21/n 1 | 12.8223; 5.245; 14.5064 90; 111.569; 90 | 907.28 | Poręba, Tomasz; Świątkowski, Marcin; Confalonieri, Giorgia Melting pseudosymmetry and thermal expansion in 3-benzoylpropionic acid CrystEngComm, 2023, 25, 5932-5941 |
7247470 | CIF | C10 H10 O3 | P 1 21/n 1 | 12.8072; 5.24245; 14.4951 90; 111.513; 90 | 905.42 | Poręba, Tomasz; Świątkowski, Marcin; Confalonieri, Giorgia Melting pseudosymmetry and thermal expansion in 3-benzoylpropionic acid CrystEngComm, 2023, 25, 5932-5941 |
7247471 | CIF | C10 H10 O3 | P 1 21/n 1 | 12.747; 5.22886; 14.4507 90; 111.302; 90 | 897.37 | Poręba, Tomasz; Świątkowski, Marcin; Confalonieri, Giorgia Melting pseudosymmetry and thermal expansion in 3-benzoylpropionic acid CrystEngComm, 2023, 25, 5932-5941 |
7247472 | CIF | C10 H10 O3 | P 1 21/n 1 | 12.7632; 5.23201; 14.4635 90; 111.364; 90 | 899.46 | Poręba, Tomasz; Świątkowski, Marcin; Confalonieri, Giorgia Melting pseudosymmetry and thermal expansion in 3-benzoylpropionic acid CrystEngComm, 2023, 25, 5932-5941 |
7247473 | CIF | C10 H10 O3 | P 1 21/c 1 | 15.4013; 5.2236; 22.451 90; 97.71; 90 | 1789.86 | Poręba, Tomasz; Świątkowski, Marcin; Confalonieri, Giorgia Melting pseudosymmetry and thermal expansion in 3-benzoylpropionic acid CrystEngComm, 2023, 25, 5932-5941 |
7247474 | CIF | C10 H10 O3 | P 1 21/c 1 | 15.3811; 5.21845; 22.4123 90; 97.767; 90 | 1782.43 | Poręba, Tomasz; Świątkowski, Marcin; Confalonieri, Giorgia Melting pseudosymmetry and thermal expansion in 3-benzoylpropionic acid CrystEngComm, 2023, 25, 5932-5941 |
7247475 | CIF | C10 H10 O3 | P 1 21/c 1 | 15.3909; 5.22159; 22.4298 90; 97.735; 90 | 1786.17 | Poręba, Tomasz; Świątkowski, Marcin; Confalonieri, Giorgia Melting pseudosymmetry and thermal expansion in 3-benzoylpropionic acid CrystEngComm, 2023, 25, 5932-5941 |
7247476 | CIF | C10 H10 O3 | P 1 21/n 1 | 12.7932; 5.23468; 14.4811 90; 111.423; 90 | 902.77 | Poręba, Tomasz; Świątkowski, Marcin; Confalonieri, Giorgia Melting pseudosymmetry and thermal expansion in 3-benzoylpropionic acid CrystEngComm, 2023, 25, 5932-5941 |
7247477 | CIF | C10 H10 O3 | P 1 21/c 1 | 15.4043; 5.2267; 22.4631 90; 97.697; 90 | 1792.29 | Poręba, Tomasz; Świątkowski, Marcin; Confalonieri, Giorgia Melting pseudosymmetry and thermal expansion in 3-benzoylpropionic acid CrystEngComm, 2023, 25, 5932-5941 |
7203062 | CIF | C10 H10 O3 S | P 21 21 21 | 7.9083; 8.889; 14.4521 90; 90; 90 | 1015.94 | Lehane, K. Niamh; Moynihan, Edmond J. A.; Brondel, Nicolas; Lawrence, Simon E.; Maguire, Anita R. Impact of sulfur substituents on the C‒H⋯O interaction of terminal alkynes in crystal engineering CrystEngComm, 2007, 9, 1041 |
7212087 | CIF | C10 H10 O4 | P 1 21/n 1 | 4.6363; 10.3293; 19.5855 90; 93.632; 90 | 936.06 | Hursthouse, Michael B.; Montis, Riccardo; Tizzard, Graham J. Intriguing relationships and associations in the crystal structures of a family of substituted aspirin molecules CrystEngComm, 2010, 12, 953 |
7212092 | CIF | C10 H10 O4 | P 1 21/n 1 | 10.1301; 4.8831; 18.9682 90; 100.696; 90 | 921.98 | Hursthouse, Michael B.; Montis, Riccardo; Tizzard, Graham J. Intriguing relationships and associations in the crystal structures of a family of substituted aspirin molecules CrystEngComm, 2010, 12, 953 |
7241587 | CIF | C10 H10 O4 | P 1 21/n 1 | 7.2043; 11.578; 11.3815 90; 105.771; 90 | 913.61 | Wang, Zhihan; Flores, Quinton; Guo, Hongye; Trevizo, Raquel; Zhang, Xiaochan; Wang, Shihan Crystal engineering construction of caffeic acid derivatives with potential applications in pharmaceuticals and degradable polymeric materials CrystEngComm, 2020, 22, 7847-7857 |
7215303 | CIF | C10 H10 O5 | P 1 21/c 1 | 9.5451; 14.2427; 7.3811 90; 102.716; 90 | 978.83 | Hursthouse, Michael B.; Montis, Riccardo; Tizzard, Graham J. Further crystal structures for the substituted aspirin family of molecules: the first aspirin carboxylate catemer and a detailed assessment of the subtle influences of weak intermolecular interactions CrystEngComm, 2011, 13, 3390 |
7215305 | CIF | C10 H10 O5 | P 1 21/n 1 | 5.0688; 9.4619; 20.0281 90; 94.069; 90 | 958.14 | Hursthouse, Michael B.; Montis, Riccardo; Tizzard, Graham J. Further crystal structures for the substituted aspirin family of molecules: the first aspirin carboxylate catemer and a detailed assessment of the subtle influences of weak intermolecular interactions CrystEngComm, 2011, 13, 3390 |
7215306 | CIF | C10 H10 O5 | P 1 21/c 1 | 5.0385; 17.3609; 10.8931 90; 95.402; 90 | 948.62 | Hursthouse, Michael B.; Montis, Riccardo; Tizzard, Graham J. Further crystal structures for the substituted aspirin family of molecules: the first aspirin carboxylate catemer and a detailed assessment of the subtle influences of weak intermolecular interactions CrystEngComm, 2011, 13, 3390 |
7212704 | CIF | C10 H10 O5 Pb S | P 1 21/n 1 | 9.4887; 7.4979; 18.1593 90; 91.634; 90 | 1291.42 | Lin, Jian-Di; Wu, Shu-Ting; Li, Zhi-Hua; Du, Shao-Wu A series of novel Pb(ii) or Pb(ii)/M(ii) (M = Ca and Sr) hybrid inorganic‒organic frameworks based on polycarboxylic acids with diverse Pb‒O‒M (M = Pb, Ca and Sr) inorganic connectivities CrystEngComm, 2010, 12, 4252 |
7240930 | CIF | C10 H10 O7 | P -1 | 5.7358; 7.1947; 13.6224 102.176; 92.789; 108.166 | 518.15 | Yang, Jinyue; Wang, Na; Tian, Beiqian; Ji, Xiongtao; Hou, Baohong; Wang, Ting; Huang, Xin; Su, Junquan; Yang, Zhanao; Hao, Hongxun Multicomponent supramolecular assembly of p-hydroxybenzoic acid and malonic acid: a deep insight into the formation of selective cocrystal CrystEngComm, 2020 |
7200770 | CIF | C10 H10 O7 U | P b c a | 8.5125; 11.569; 25.143 90; 90; 90 | 2476.1 | Thuéry, Pierre Uranyl‒organic bilayer assemblies with flexible aromatic di-, tri- and tetracarboxylic acids CrystEngComm, 2009, 11, 1081 |
7201823 | CIF | C10 H10 Ru | P n m a | 7.0121; 8.8234; 12.7646 90; 90; 90 | 789.753 | Borissova, Alexandra O.; Antipin, Mikhail Yu.; Perekalin, Dmirtrii S.; Lyssenko, Konstantin A. Crucial role of Ru⋯H interactions in the crystal packing of ruthenocene and its derivatives CrystEngComm, 2008, 10, 827 |
7245639 | CIF | C10 H10 S6 Se2 | P 1 21/c 1 | 15.7509; 13.2011; 15.8501 90; 105.818; 90 | 3170.9 | Beau, Maxime; Jeannin, olivier; Fourmigué, Marc; Senzier, Pascale; Barriere, Frederic; Jeon, Ie-Rang Oxidation-induced activation of chalcogen bonding in redox-active bis(selenomethyl)tetrathiafulvalene derivatives CrystEngComm, 2022 |
7202105 | CIF | C10 H10.67 Cu Dy2 N4 O12.83 | R -3 :H | 27.42; 27.42; 7.0011 90; 90; 120 | 4558.6 | Chen, Lan-Fen; Zhang, Jian; Ren, Guo-Qiang; Zhao-Ji Li,; Qin, Ye-Yan; Yin, Pei-Xiu; Cheng, Jian-Kai; Yao, Yuan-Gen Nanosized lanthanide oxide rods in I1O3 hybrid organic‒inorganic frameworks involving in situ ligand synthesis CrystEngComm, 2008, 10, 1088 |
7202107 | CIF | C10 H10.67 Cu Er2 N4 O12.83 | R -3 :H | 27.294; 27.294; 6.9565 90; 90; 120 | 4488 | Chen, Lan-Fen; Zhang, Jian; Ren, Guo-Qiang; Zhao-Ji Li,; Qin, Ye-Yan; Yin, Pei-Xiu; Cheng, Jian-Kai; Yao, Yuan-Gen Nanosized lanthanide oxide rods in I1O3 hybrid organic‒inorganic frameworks involving in situ ligand synthesis CrystEngComm, 2008, 10, 1088 |
7202106 | CIF | C10 H10.67 Cu Ho2 N4 O12.83 | R -3 :H | 27.3601; 27.3601; 6.9815 90; 90; 120 | 4526 | Chen, Lan-Fen; Zhang, Jian; Ren, Guo-Qiang; Zhao-Ji Li,; Qin, Ye-Yan; Yin, Pei-Xiu; Cheng, Jian-Kai; Yao, Yuan-Gen Nanosized lanthanide oxide rods in I1O3 hybrid organic‒inorganic frameworks involving in situ ligand synthesis CrystEngComm, 2008, 10, 1088 |
7210305 | CIF | C10 H104 As4 N2 Na10 O199 Tb6 W44 | P -1 | 13.085; 19.689; 22.821 104.33; 95.37; 104.76 | 5431 | Feng, Xiao-Jia; Han, Hua-Yan; Wang, Yong-Hui; Li, Lu-Lu; Li, Yang-Guang; Wang, En-Bo Assembly of chainlike polyoxometalate-based lanthanide complexes in one-pot reaction system CrystEngComm, 2013, 15, 7267 |
7244852 | CIF | C10 H11 Au Br3 N2 O2 | P 1 | 7.3049; 7.9398; 14.1403 91.892; 101.92; 99.075 | 790.57 | Pizzi, Andrea; Calabrese, Miriam; Daolio, Andrea; Ursini, Maurizio; Frontera, Antonio; Resnati, Giuseppe Expanding the toolbox of coinage bond: Adducts involving new gold(III) derivatives and bioactive molecules CrystEngComm, 2022 |
7221745 | CIF | C10 H11 Br I N4 O2 S | P -1 | 5.7185; 11.644; 12.3493 116.697; 91.7117; 104.17 | 702.94 | Pan, F.; Puttreddy, R.; Rissanen, K.; Englert, U. Synthesis of tetrahalide dianions directed by crystal engineering CrystEngComm, 2015, 17, 6641 |
7218906 | CIF | C10 H11 Br N6 O | P b c a | 11.3672; 7.2817; 30.1714 90; 90; 90 | 2497.36 | Seth, Saikat Kumar; Lee, Vannajan Sanghiran; Yana, Janchai; Zain, Sharifuddin M.; Cunha, Anna C.; Ferreira, Vitor F.; Jordão, Alessandro K.; de Souza, Maria C. B. V.; Wardell, Solange M. S. V.; Wardell, James L.; Tiekink, Edward R. T. Crystallographic and computational study of 1-(arylamino)-1,2,3-triazole-4-carbohydrazides CrystEngComm, 2015, 17, 2255 |
7244280 | CIF | C10 H11 Br O5 | P 1 21/n 1 | 4.8141; 27.892; 8.7246 90; 104.63; 90 | 1133.51 | Edkins, Katharina; Tweedy, Jane; Fung, Stephanie; Edkins, Robert M. Steric influence on solvate formation – a comparison of resorcylic acid and two brominated derivatives CrystEngComm, 2022 |
7244283 | CIF | C10 H11 Br2 N O5 | P n a 21 | 17.681; 3.8913; 18.1986 90; 90; 90 | 1252.1 | Edkins, Katharina; Tweedy, Jane; Fung, Stephanie; Edkins, Robert M. Steric influence on solvate formation – a comparison of resorcylic acid and two brominated derivatives CrystEngComm, 2022 |
7244151 | CIF | C10 H11 Cd N O8 | P -1 | 7.2467; 8.5509; 10.9978 101.892; 95.728; 114.776 | 592.04 | Rixson, Daniel; Günay Sezer, Güneş; Alp, Emre; Mahon, Mary F.; Burrows, Andrew D. Synthesis, structures and properties of metal–organic frameworks prepared using a semi-rigid tricarboxylate linker CrystEngComm, 2022, 24, 863-876 |
7221744 | CIF | C10 H11 Cl I N4 O2 S | P -1 | 5.6561; 11.4126; 12.2064 116.614; 91.131; 104.114 | 675.58 | Pan, F.; Puttreddy, R.; Rissanen, K.; Englert, U. Synthesis of tetrahalide dianions directed by crystal engineering CrystEngComm, 2015, 17, 6641 |
7223344 | CIF | C10 H11 Cl N2 O2 | P 1 21/n 1 | 7.65; 7.943; 18.15 90; 92.26; 90 | 1102 | Tarai, Arup; Baruah, Jubaraj B. Oxime synthons in the salts and cocrystals of quinoline-4-carbaldoxime for non-covalent synthesis CrystEngComm, 2016, 18, 298 |
7215295 | CIF | C10 H11 Cl N2 O3 | P -1 | 7.2013; 7.3815; 11.328 77.121; 77.612; 75.969 | 561.2 | Cui, Ke-Hui; Yao, Shi-Yan; Li, Hai-Qin; Li, Yan-Tao; Zhao, Hai-Ping; Jiang, Chun-Jie; Tian, Yun-Qi Acentric and chiral four-connected metal‒organic frameworks based on the racemic binaphthol-like chiral ligand of 4-(1-H(or methyl)-imidaozol-1-yl)benzoic acid CrystEngComm, 2011, 13, 3432 |
7208765 | CIF | C10 H11 Cl N4 O | P 1 21/c 1 | 13.4984; 6.6361; 14.0835 90; 118.38; 90 | 1109.93 | Jordão, Alessandro K.; Ferreira, Vitor F.; Cunha, Anna C.; Wardell, James L.; Wardell, Solange M. S. V.; Tiekink, Edward R. T. The differing influence of halides upon supramolecular aggregation through C‒X⋯π interactions in the crystal structures of (5-methyl-1-(4-X-arylamino)-1H-1,2,3-triazol-4-yl)methanol derivatives, X = H, F and Cl CrystEngComm, 2012, 14, 6534 |
7218905 | CIF | C10 H11 Cl N6 O | P b c a | 11.4176; 7.2174; 29.6018 90; 90; 90 | 2439.35 | Seth, Saikat Kumar; Lee, Vannajan Sanghiran; Yana, Janchai; Zain, Sharifuddin M.; Cunha, Anna C.; Ferreira, Vitor F.; Jordão, Alessandro K.; de Souza, Maria C. B. V.; Wardell, Solange M. S. V.; Wardell, James L.; Tiekink, Edward R. T. Crystallographic and computational study of 1-(arylamino)-1,2,3-triazole-4-carbohydrazides CrystEngComm, 2015, 17, 2255 |
7244147 | CIF | C10 H11 Co N O8 | P 1 21 1 | 4.8412; 10.1675; 11.332 90; 95.158; 90 | 555.54 | Rixson, Daniel; Günay Sezer, Güneş; Alp, Emre; Mahon, Mary F.; Burrows, Andrew D. Synthesis, structures and properties of metal–organic frameworks prepared using a semi-rigid tricarboxylate linker CrystEngComm, 2022, 24, 863-876 |
7206014 | CIF | C10 H11 Co N3 O7 | P 1 21/c 1 | 10.446; 16.862; 7.3912 90; 96.063; 90 | 1294.6 | Li, Yan; Zou, Wen-Qiang; Wu, Mei-Feng; Lin, Jian-Di; Zheng, Fa-Kun; Liu, Zhi-Fa; Wang, Shuai-Hua; Guo, Guo-Cong; Huang, Jin-Shun Hydrothermal syntheses, crystal structures and magnetic properties of four Mn(ii) and Co(ii) coordination polymers generated from new carboxylate-introduced 1,2,3-triazole ligands CrystEngComm, 2011, 13, 3868 |
7234031 | CIF | C10 H11 Cu N O3 | P 43 21 2 | 8.848; 8.848; 24.929 90; 90; 90 | 1951.6 | Muthukumar, Pandi; Moon, Dohyun; Anthony, Savarimuthu Philip The Co2+/Ni2+ ion-mediated formation of a topochemically converted copper coordination polymer: structure-dependent electrocatalytic activity CrystEngComm, 2019, 21, 6552 |
7233420 | CIF | C10 H11 Cu N O5 | P -3 m 1 | 18.5382; 18.5382; 6.7599 90; 90; 120 | 2011.9 | McHugh, Lauren N.; Olivera Perez, Leonardo J.; Wheatley, Paul S.; Cordes, David B.; Slawin, Alexandra M. Z.; Morris, Russell E. Synthesis and structural characterisation of the copper MOF: STAM-NMe2 CrystEngComm, 2019, 21, 5387 |
7209810 | CIF | C10 H11 Cu N3 S2 | P 1 21/c 1 | 10.2175; 11.0524; 10.7815 90; 94.854; 90 | 1213.17 | Li, Li; Yue, Jun-Ming; Qiao, Yong-Zhen; Niu, Yun-Yin; Hou, Hong-Wei The side chain template effect in viologen on the formation of polypseudorotaxane architecture: six novel metal coordination polymers and their properties CrystEngComm, 2013, 15, 3835 |
7205275 | CIF | C10 H11 Cu3 O13 S | P -1 | 8.7544; 10.1037; 10.4206 72.928; 79.968; 69.699 | 823.68 | Zhao, Li-Min; Zhang, Zhen-Jie; Zhang, Shi-Yuan; Cui, Ping; Shi, Wei; Zhao, Bin; Cheng, Peng; Liao, Dai-Zheng; Yan, Shi-Ping Metal‒organic frameworks based on transition-metal carboxylate clusters as secondary building units: synthesis, structures and properties CrystEngComm, 2011, 13, 907 |
7209523 | CIF | C10 H11 Dy O10 | P 1 21/c 1 | 8.9378; 15.708; 8.9066 90; 100.67; 90 | 1228.8 | Zhao, Xiao-Qing; Liu, Xu-Hui; Li, Ji-Jing; Zhao, Bin Syntheses, structures, photoluminescence and magnetic properties of four-connected lanthanide‒tricarboxylate coordination polymers CrystEngComm, 2013, 15, 3308 |
7242741 | CIF | C10 H11 Dy O8 | P 1 21/c 1 | 7.1516; 15.1815; 10.5616 90; 90.44; 90 | 1146.66 | Sen, Rupam; Paul, Sanchayeeta; Sarkar, Alolika; Botas, Alexandre M. P.; Carneiro Neto, Albano N.; Brandão, Paula; Lopes, Armandina M. L.; Ferreira, Rute A. S.; Araújo, João P.; Lin, Zhi A new series of 3D lanthanide phenoxycarboxylates: synthesis, crystal structure, magnetism and photoluminescence studies CrystEngComm, 2021, 23, 4143-4151 |
7209524 | CIF | C10 H11 Er O10 | P 1 21/c 1 | 8.9007; 15.592; 8.8728 90; 100.63; 90 | 1210.2 | Zhao, Xiao-Qing; Liu, Xu-Hui; Li, Ji-Jing; Zhao, Bin Syntheses, structures, photoluminescence and magnetic properties of four-connected lanthanide‒tricarboxylate coordination polymers CrystEngComm, 2013, 15, 3308 |
7209525 | CIF | C10 H11 Eu O10 | P 1 21/c 1 | 8.96312; 15.7701; 8.95189 90; 100.376; 90 | 1244.65 | Zhao, Xiao-Qing; Liu, Xu-Hui; Li, Ji-Jing; Zhao, Bin Syntheses, structures, photoluminescence and magnetic properties of four-connected lanthanide‒tricarboxylate coordination polymers CrystEngComm, 2013, 15, 3308 |
7211871 | CIF | C10 H11 Eu O9 | P 1 21/n 1 | 11.673; 5.9691; 18.456 90; 97.65; 90 | 1274.5 | Wang, Zhuo; Xing, Yong-Heng; Wang, Chun-Guang; Sun, Li-Xian; Zhang, Jian; Ge, Mao-Fa; Niu, Shu-Yun Synthesis, structure and luminescent properties of coordination polymers with 1,2-benzenedicarboxylic acid and a series of flexible dicarboxylate ligands CrystEngComm, 2010, 12, 762 |
7208764 | CIF | C10 H11 F N4 O | P 1 21/n 1 | 13.4975; 6.642; 13.5534 90; 118.641; 90 | 1066.39 | Jordão, Alessandro K.; Ferreira, Vitor F.; Cunha, Anna C.; Wardell, James L.; Wardell, Solange M. S. V.; Tiekink, Edward R. T. The differing influence of halides upon supramolecular aggregation through C‒X⋯π interactions in the crystal structures of (5-methyl-1-(4-X-arylamino)-1H-1,2,3-triazol-4-yl)methanol derivatives, X = H, F and Cl CrystEngComm, 2012, 14, 6534 |
7209526 | CIF | C10 H11 Gd O10 | P 1 21/c 1 | 8.9811; 15.7995; 8.9343 90; 100.505; 90 | 1246.5 | Zhao, Xiao-Qing; Liu, Xu-Hui; Li, Ji-Jing; Zhao, Bin Syntheses, structures, photoluminescence and magnetic properties of four-connected lanthanide‒tricarboxylate coordination polymers CrystEngComm, 2013, 15, 3308 |
7209527 | CIF | C10 H11 Ho O10 | P 1 21/c 1 | 8.93845; 15.6658; 8.88816 90; 100.648; 90 | 1223.16 | Zhao, Xiao-Qing; Liu, Xu-Hui; Li, Ji-Jing; Zhao, Bin Syntheses, structures, photoluminescence and magnetic properties of four-connected lanthanide‒tricarboxylate coordination polymers CrystEngComm, 2013, 15, 3308 |
7221748 | CIF | C10 H11 I2 N4 O2 S | P -1 | 5.7879; 11.983; 12.568 61.725; 87.456; 76.227 | 743.2 | Pan, F.; Puttreddy, R.; Rissanen, K.; Englert, U. Synthesis of tetrahalide dianions directed by crystal engineering CrystEngComm, 2015, 17, 6641 |
7221750 | CIF | C10 H11 I5 N4 O2 S | P -1 | 8.004; 11.247; 11.473 83.925; 89.442; 72.371 | 978.5 | Pan, F.; Puttreddy, R.; Rissanen, K.; Englert, U. Synthesis of tetrahalide dianions directed by crystal engineering CrystEngComm, 2015, 17, 6641 |
7242743 | CIF | C10 H11 La O8 | P 1 21/c 1 | 7.0577; 15.098; 10.5128 90; 90.412; 90 | 1120.19 | Sen, Rupam; Paul, Sanchayeeta; Sarkar, Alolika; Botas, Alexandre M. P.; Carneiro Neto, Albano N.; Brandão, Paula; Lopes, Armandina M. L.; Ferreira, Rute A. S.; Araújo, João P.; Lin, Zhi A new series of 3D lanthanide phenoxycarboxylates: synthesis, crystal structure, magnetism and photoluminescence studies CrystEngComm, 2021, 23, 4143-4151 |
7209528 | CIF | C10 H11 Lu O10 | P 1 21/c 1 | 8.9151; 15.521; 8.8732 90; 100.58; 90 | 1206.9 | Zhao, Xiao-Qing; Liu, Xu-Hui; Li, Ji-Jing; Zhao, Bin Syntheses, structures, photoluminescence and magnetic properties of four-connected lanthanide‒tricarboxylate coordination polymers CrystEngComm, 2013, 15, 3308 |
7210300 | CIF | C10 H11 Mn N O5 S | C 1 2/c 1 | 11.857; 18.273; 11.496 90; 99.2; 90 | 2459 | Tan, Yan-Xi; He, Yan-Ping; Zhang, Ying; Zheng, Yan-Jun; Zhang, Jian Solvent controlled assembly of four Mn(ii)-2,5-thiophenedicarboxylate frameworks with rod-packing architectures and magnetic properties CrystEngComm, 2013, 15, 6009 |
7203446 | CIF | C10 H11 N | P -1 | 18.2204; 19.0609; 19.287 105.18; 113.6; 108.25 | 5220.5 | Andrei S. Batsanov; Jonathan C. Collings; Richard M. Ward; Andrés E. Goeta; Laurent Porrès; Andrew Beeby; Judith A. K. Howard; Jonathan W. Steed; Todd B. Marder Part 2. Structures of 4-trimethylsilylethynyl-<i>N</i>,<i>N</i>-dimethylaniline, and 4-ethynyl-<i>N</i>,<i>N</i>-dimethylaniline with <i>Z</i>′ = 12 and a single-crystal to single-crystal phase transition at 122.5 ± 2 K CrystEngComm, 2006, 8, 622 |
7203447 | CIF | C10 H11 N | P -1 | 17.412; 18.845; 19.252 105.84; 104.51; 112.99 | 5119.4 | Andrei S. Batsanov; Jonathan C. Collings; Richard M. Ward; Andrés E. Goeta; Laurent Porrès; Andrew Beeby; Judith A. K. Howard; Jonathan W. Steed; Todd B. Marder Part 2. Structures of 4-trimethylsilylethynyl-<i>N</i>,<i>N</i>-dimethylaniline, and 4-ethynyl-<i>N</i>,<i>N</i>-dimethylaniline with <i>Z</i>′ = 12 and a single-crystal to single-crystal phase transition at 122.5 ± 2 K CrystEngComm, 2006, 8, 622 |
7216127 | CIF | C10 H11 N O2 S | P -1 | 5.6059; 7.9101; 11.9617 99.223; 101.517; 100.21 | 500.87 | Ho, Soo Yei; Bettens, Ryan P. A.; Dakternieks, Dainis; Duthie, Andrew; Tiekink, Edward R. T. Prevalence of the thioamide {⋯H‒N‒CS}2 synthon—solid-state (X-ray crystallography), solution (NMR) and gas-phase (theoretical) structures of O-methyl-N-aryl-thiocarbamides CrystEngComm, 2005, 7, 682 |
7216129 | CIF | C10 H11 N O3 S | P 1 21/n 1 | 8.1538; 6.8174; 18.976 90; 97.586; 90 | 1045.6 | Ho, Soo Yei; Bettens, Ryan P. A.; Dakternieks, Dainis; Duthie, Andrew; Tiekink, Edward R. T. Prevalence of the thioamide {⋯H‒N‒CS}2 synthon—solid-state (X-ray crystallography), solution (NMR) and gas-phase (theoretical) structures of O-methyl-N-aryl-thiocarbamides CrystEngComm, 2005, 7, 682 |
7201806 | CIF | C10 H11 N O4 | P -1 | 9.2426; 10.3797; 10.4421 83.59; 89.104; 85.167 | 991.9 | Haynes, Delia A.; Pietersen, Lauren K. Hydrogen bonding networks in ammonium carboxylate salts : the crystal structures of phenylethylammonium fumarate-fumaric acid, phenylethylammonium succinate-succinic acid and anilinium fumarate-fumaric acid CrystEngComm, 2008, 10, 518 |
7238490 | CIF | C10 H11 N O4 | P b c a | 10.3173; 7.4516; 26.221 90; 90; 90 | 2015.9 | Wang, Lei; Zhao, Lei; Xu, Lingyan; Chen, Ruixin; Yang, Yu Interesting organic supramolecular structures constructed by piperazine/N,N′-dimethylpiperazine with aromatic multicomponent acids: synthon cooperation and structural diversity CrystEngComm, 2012, 14, 6998 |
7246933 | CIF | C10 H11 N O4 | P 1 n 1 | 9.5646; 3.7993; 13.5636 90; 106.084; 90 | 473.59 | Gao, Lijie; Wang, Meng; Li, Shuyu; Chen, Kui; Zhou, Lina; Li, Xin; Wang, Na; Huang, Xin; Hao, Hongxun; Wang, Ting Real-time fluorescence visualization of the evaporation crystallization process based on the AIEE mechanism CrystEngComm, 2023, 25, 4064-4075 |
7246934 | CIF | C10 H11 N O4 | P 1 21/c 1 | 7.1188; 18.663; 7.959 90; 106.09; 90 | 1016 | Gao, Lijie; Wang, Meng; Li, Shuyu; Chen, Kui; Zhou, Lina; Li, Xin; Wang, Na; Huang, Xin; Hao, Hongxun; Wang, Ting Real-time fluorescence visualization of the evaporation crystallization process based on the AIEE mechanism CrystEngComm, 2023, 25, 4064-4075 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!