Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1000191 | CIF | Ag0.5 Cr0.5 P S3 | P 1 2/a 1 | 5.892; 10.632; 6.745 90; 105.88; 90 | 406.4 | Colombet, P; Leblanc, A; Danot, M; Rouxel, J Coordinance inhabituelle de l'argent dans un sufur lamellaire a sous- reseau magnetique 1D: le compose Ag~.5~ Cr~.5~ P S~3~ Nouveau Journal de Chimie, 1983, 7, 333-338 |
| 1000192 | CIF | Ag0.5 Cr0.5 P S3 | P 1 2/a 1 | 5.892; 10.632; 6.745 90; 105.88; 90 | 406.4 | Colombet, P; Leblanc, A; Danot, M; Rouxel, J Coordinance inhabituelle de l'argent dans un sufur lamellaire a sous- reseau magnetique 1D: le compose Ag~.5~ Cr~.5~ P S~3~ Nouveau Journal de Chimie, 1983, 7, 333-338 |
| 7053281 | CIF | Ag2 As8 Fe3 Na5 O28 | C 1 2/c 1 | 9.9512; 8.5741; 28.8231 90; 93.91; 90 | 2453.54 | Quarez, Eric; Mentré, Olivier; Djellab, Karim; Masquelier, Christian Crystal structures and sodium/silver distributions within the ionic conductors Na5Ag2Fe3(As2O7)4 and Na2Ag5Fe3(P2O7)4 New Journal of Chemistry, 2010, 34, 287 |
| 7053280 | CIF | Ag2.001 As8 Fe3 Na4.999 O28 | C 1 2/c 1 | 9.9732; 8.5492; 28.664 90; 94.152; 90 | 2437.6 | Quarez, Eric; Mentré, Olivier; Djellab, Karim; Masquelier, Christian Crystal structures and sodium/silver distributions within the ionic conductors Na5Ag2Fe3(As2O7)4 and Na2Ag5Fe3(P2O7)4 New Journal of Chemistry, 2010, 34, 287 |
| 7053282 | CIF | Ag5 Fe3 Na2 O28 P8 | C 1 2/c 1 | 9.5375; 8.3886; 28.0971 90; 93.623; 90 | 2243.45 | Quarez, Eric; Mentré, Olivier; Djellab, Karim; Masquelier, Christian Crystal structures and sodium/silver distributions within the ionic conductors Na5Ag2Fe3(As2O7)4 and Na2Ag5Fe3(P2O7)4 New Journal of Chemistry, 2010, 34, 287 |
| 7053283 | CIF | Ag5 Fe3 Na2 O28 P8 | C 1 2/c 1 | 28.551; 8.3631; 30.064 90; 111.89; 90 | 6661 | Quarez, Eric; Mentré, Olivier; Djellab, Karim; Masquelier, Christian Crystal structures and sodium/silver distributions within the ionic conductors Na5Ag2Fe3(As2O7)4 and Na2Ag5Fe3(P2O7)4 New Journal of Chemistry, 2010, 34, 287 |
| 7051673 | CIF | Ag7 As8 Fe3 O28 | P 1 21/c 1 | 9.9139; 8.6068; 28.904 90; 93.317; 90 | 2462.2 | Quarez, Eric; Mentré, Olivier; Oumellal, Yassine; Masquelier, Christian Crystal structures of new silver ion conductors Ag7Fe3(X2O7)4 (X = P, As) New Journal of Chemistry, 2009, 33, 998 |
| 7051674 | CIF | Ag7 As8 Fe3 O28 | C 1 2/c 1 | 9.9285; 8.6101; 29.039 90; 93.5228; 90 | 2477.72 | Quarez, Eric; Mentré, Olivier; Oumellal, Yassine; Masquelier, Christian Crystal structures of new silver ion conductors Ag7Fe3(X2O7)4 (X = P, As) New Journal of Chemistry, 2009, 33, 998 |
| 7051671 | CIF | Ag7 Fe3 O28 P8 | P 1 21/c 1 | 9.532; 8.421; 28.021 90; 93.225; 90 | 2245.7 | Quarez, Eric; Mentré, Olivier; Oumellal, Yassine; Masquelier, Christian Crystal structures of new silver ion conductors Ag7Fe3(X2O7)4 (X = P, As) New Journal of Chemistry, 2009, 33, 998 |
| 7051672 | CIF | Ag7 Fe3 O28 P8 | C 1 2/c 1 | 9.5561; 8.4417; 28.2257 90; 93.465; 90 | 2272.8 | Quarez, Eric; Mentré, Olivier; Oumellal, Yassine; Masquelier, Christian Crystal structures of new silver ion conductors Ag7Fe3(X2O7)4 (X = P, As) New Journal of Chemistry, 2009, 33, 998 |
| 7055456 | CIF | Al N O8 Si Y4 | P 1 21/c 1 | 7.4491; 10.3933; 11.0563 90; 109.711; 90 | 805.831 | Hua, Youjie; Li, Xiaojun; Zhang, Dawei; Ma, Hongping; Deng, Degang; Xu, Shiqing The crystal structure and luminescence properties of novel Ce3+and Ce3+, Sm3±activated Y4SiAlO8N phosphors for near-UV white LEDs New J. Chem., 2016, 40, 5458 |
| 7059611 | CIF | Al2 B2 F2 O6 Sn | I 41/a m d :2 | 11.828; 11.828; 10.242 90; 90; 90 | 1432.9 | Wang, Ya; Han, Jian; Huang, Junben; Yang, Zhihua; Huang, Shuzhao; Pan, Shilie From BaAl2(BO3)2O to SnAl2(BO3)2F2: structure transformation based on ion regulation New Journal of Chemistry, 2020, 44, 9852-9857 |
| 7053892 | CIF | Al3 K6 Na3 O24 P6 | P 1 21/c 1 | 19.9204; 9.6139; 13.2845 90; 98.934; 90 | 2513.3 | Wang, Ying; Pan, Shilie; Han, Shujuan; Dong, Lingyun; Zhang, Min; Wu, Kui Synthesis and characterization of a new aluminophosphate with a Al3P6O249− three-dimensional framework New Journal of Chemistry, 2014, 38, 889 |
| 7055443 | CIF | Al4.68 B8 La2 O22 | P -6 2 m | 4.6149; 4.6149; 18.72 90; 90; 120 | 345.27 | Guo, Shu; Liu, Lijuan; Xia, Mingjun; Wang, Xiaoyang; Bai, Lei; Xu, Bo; Huang, Qian; Chen, Chuangtian Crystal growth, structure and optical properties of a new acentric crystal La2Al4.68B8O22with a short UV absorption edge New J. Chem., 2016, 40, 4870 |
| 7053683 | CIF | As F10 H2 Tl | P 1 21/c 1 | 5.5533; 5.7652; 21.9287 90; 93.279; 90 | 700.92 | Mazej, Zoran; Goreshnik, Evgeny Fluoride ion donor properties of group 13 trifluorides (MF3, M = Al, Ga, In, Tl) and crystal structures of InF3·3SbF5, TlF3·3SbF5 and TlF3·AsF5·2HF New Journal of Chemistry, 2010, 34, 2806 |
| 7055713 | CIF | B Gd3 O3 S3 | P -1 | 3.9725; 7.5945; 11.1824 91.402; 91.093; 90.206 | 337.2 | Chi, Yang; Guo, Sheng-Ping; Kong, Hong-Jian; Xue, Huai-Guo Crystal and electronic structures, and optical and magnetic properties of novel rare-earth sulfide borates RE3S3BO3(RE = Sm, Gd) New J. Chem., 2016, 40, 6720 |
| 9016429 | CIF | B H2 O2 | P 1 21/c 1 | 7.409; 7.666; 7.0421 90; 116.04; 90 | 359.371 | Baber, R. A.; Norman, N. C.; Orpen, A. G.; Rossi, J. The solid-state structure of diboronic acid, B2(OH)4 New Journal of Chemistry, 2003, 27, 772-775 |
| 7056282 | CIF | B10 Ca3 O23 V2 | P -1 | 6.5251; 11.4616; 12.7135 114.126; 103.656; 90.594 | 837.09 | Chen, Zhaohui; Liu, Yaqin; Shi, Yunjing; Zhang, Wenyao; Jing, Qun; Fang, Yuan; Dong, Xiaoyu M3V2B10O23 (M = Ca, Sr): Two new vanadoborates with new [V2B10O23]\ιnfty double layers New J. Chem., 2017 |
| 7060761 | CIF | B10 La2 Na2 O19 | C 1 2/c 1 | 11.0023; 6.5793; 18.0616 90; 91.02; 90 | 1307.23 | Wu, Chengfa; Feng, Junwei; Yu, Feng Na2La2B10O19: a new lanthanum sodium borate with infinite 2D layer 2∞[B10O19]8− and moderate birefringence New Journal of Chemistry, 2021, 45, 13592-13598 |
| 7053979 | CIF | B10 O21 Pb4 Zn2 | P b c n | 14.6062; 17.4899; 13.2962 90; 90; 90 | 3396.7 | Yu, Hongwei; Wu, Hongping; Pan, Shilie; Zhang, Bingbing; Dong, Lingyun; Han, Shujuan; Yang, Zhihua Pb4Zn2B10O21: a congruently melting lead zinc borate with a novel [B10O24] anionic group and an interesting [Pb4O12]∞chain New Journal of Chemistry, 2014, 38, 285 |
| 7056283 | CIF | B10 O23 Sr3 V2 | P -1 | 6.639; 11.571; 12.998 114.333; 103.334; 90.432 | 879.3 | Chen, Zhaohui; Liu, Yaqin; Shi, Yunjing; Zhang, Wenyao; Jing, Qun; Fang, Yuan; Dong, Xiaoyu M3V2B10O23 (M = Ca, Sr): Two new vanadoborates with new [V2B10O23]\ιnfty double layers New J. Chem., 2017 |
| 7057510 | CIF | B11 H6 N O18 | C 1 2/c 1 | 14.103; 10.167; 10.86 90; 106.765; 90 | 1491 | Huang, Chunmei; Zhang, Fangfang; Zhang, Bingbing; Yang, Zhihua; Pan, Shilie NH4B11O16(OH)2: a new ammonium borate with wavy-shaped polycyclic 2∞[B11O16(OH)2] layers New Journal of Chemistry, 2018, 42, 12091 |
| 7061927 | CIF | B12 Ba0.58 Ca0.42 Li7 O24 Sc | R -3 :H | 14.9; 14.9; 6.5867 90; 90; 120 | 1266.4 | Chen, Jianbang; Zhang, Jie; Zhu, Aixin; Huang, Xuchu Li7SrScB12O24 and Li7Ba0.6Ca0.4ScB12O24: two new quaternary rare-earth borates with short UV cutoff edges New Journal of Chemistry, 2022, 46, 19629-19632 |
| 7061928 | CIF | B12 Li7 O24 Sc Sr | R -3 :H | 14.8742; 14.8742; 6.5524 90; 90; 120 | 1255.4 | Chen, Jianbang; Zhang, Jie; Zhu, Aixin; Huang, Xuchu Li7SrScB12O24 and Li7Ba0.6Ca0.4ScB12O24: two new quaternary rare-earth borates with short UV cutoff edges New Journal of Chemistry, 2022, 46, 19629-19632 |
| 7053242 | CIF | B16 Cd3 H53.5 Na3.5 O79.5 V12 | P -1 | 12.393; 12.925; 20.31 93.317; 91.661; 100.267 | 3193 | Liu, Xing; Zhou, Jian; Xiao, Hong-Ping; Kong, Chunyang; Zou, Huahong; Tang, Qiuling; Li, Jianhui Two new 3-D boratopolyoxovanadate architectures based on the [V12B16O50(OH)8]12− cluster with different metal linkers New Journal of Chemistry, 2013, 37, 4077 |
| 7053243 | CIF | B16 H51 Na O76 V12 Zn2 | C 1 2/c 1 | 17.048; 17.431; 23.628 90; 90.063; 90 | 7021 | Liu, Xing; Zhou, Jian; Xiao, Hong-Ping; Kong, Chunyang; Zou, Huahong; Tang, Qiuling; Li, Jianhui Two new 3-D boratopolyoxovanadate architectures based on the [V12B16O50(OH)8]12− cluster with different metal linkers New Journal of Chemistry, 2013, 37, 4077 |
| 7061165 | CIF | B18 H56 O80 V12 | C 1 2/c 1 | 18.968; 18.443; 19.815 90; 92.77; 90 | 6924 | Liu, Xinxin; Zhang, Le; Zhao, SiSi; Guo, Biao; Zhao, Zhen Water assisted high proton conductance in a pure-inorganic framework vanadoborate New Journal of Chemistry, 2022, 46, 974-980 |
| 7059319 | CIF | B19 Ba24 O57 Rb9 | P -3 m 1 | 16.977; 16.977; 7.282 90; 90; 120 | 1817.6 | Niu, Xiaowen; Wang, Li Synthesis, characterization and crystal structure of a new mixed alkali and alkaline-earth metal borate Rb9Ba24(BO3)19 New Journal of Chemistry, 2020, 44, 3882-3887 |
| 7050579 | CIF | B2 H4 O4 | P 1 21/c 1 | 7.409; 7.666; 7.0421 90; 116.04; 90 | 359.37 | Baber, R. Angharad; Norman, Nicholas C.; Orpen, A. Guy; Rossi, Jean The solid-state structure of diboronic acid, B2(OH)4 New Journal of Chemistry, 2003, 27, 773 |
| 7062810 | CIF | B2 Mg3.17 Ni6.83 | R -3 m :H | 4.9496; 4.9496; 20.48 90; 90; 120 | 434.511 | Zhang, Weidong; Zhou, Juanfang; Zhang, Chao; Liu, Xinliang Aggregation-induced emission and reversible mechanoresponsive behavior of boryl substituted phenothiazine New Journal of Chemistry, 2023, 47, 20510-20516 |
| 7057546 | CIF | B3 Ba Li O9 Zn3 | P 1 2/c 1 | 6.583; 4.933; 12.34 90; 90.968; 90 | 400.7 | Chen, Yanna; Zhang, Min; Pan, Shilie BaLiZn3(BO3)3: a new member of the KBe2BO3F2 family possessing dense BO3 triangles and the smallest interlayer distance New Journal of Chemistry, 2018, 42, 12365 |
| 7056068 | CIF | B3 Be3 F4 Li O9 Sr3 | R 3 m :H | 10.3062; 10.3062; 8.3458 90; 90; 120 | 767.7 | Guo, Shu; Liang, Fei; Liu, Lijuan; Xia, Mingjun; Fang, Zhi; Wu, Ruofei; Wang, Xiaoyang; Lin, Zheshuai; Chen, Chuangtian LiSr3Be3B3O9F4: A New Ultraviolet Nonlinear Optical Crystal for Fourth-harmonic Generation of Nd:YAG Lasers New J. Chem., 2017 |
| 7058371 | CIF | B3 Ca4 K O9 | A m a 2 | 10.621; 11.489; 6.534 90; 90; 90 | 797 | Ren, Peng; Yang, Yun; Li, Hao; Yang, Zhihua; Pan, Shilie Two alkali calcium borates exhibiting second harmonic generation and deep-UV cutoff edges New Journal of Chemistry, 2019, 43, 9354 |
| 7058372 | CIF | B3 Ca4 K0.59 O9 Rb0.41 | A m a 2 | 10.62; 11.543; 6.523 90; 90; 90 | 799.6 | Ren, Peng; Yang, Yun; Li, Hao; Yang, Zhihua; Pan, Shilie Two alkali calcium borates exhibiting second harmonic generation and deep-UV cutoff edges New Journal of Chemistry, 2019, 43, 9354 |
| 7055225 | CIF | B3 Cd4 Nd O10 | C 1 m 1 | 8.0536; 15.872; 3.5364 90; 100.268; 90 | 444.81 | Wang, Xing; Xia, Mingjun; Li, R. K. Two potential self-activated orthoborates Cd4NdO(BO3)3and Ca3Nd3(BO3)5: growth, crystal structures and optical properties New J. Chem., 2016, 40, 2057 |
| 7054438 | CIF | B3 Cd4 O10 Yb | C 1 m 1 | 7.938; 15.794; 3.4414 90; 99.992; 90 | 424.9 | Zou, Guohong; Huang, Ling; Cai, Huaqiang; Wang, Shichao; Ye, Ning Synthesis and characterization of Cd4YbO(BO3)3‒ a congruent melting cadmium‒ytterbium oxyborate with large nonlinear optical properties New J. Chem., 2014, 38, 6186 |
| 7055135 | CIF | B3 Li O9 Sr Tb2 | P -3 m 1 | 10.3845; 10.3845; 6.4739 90; 90; 120 | 604.6 | Chen, Pengyun; Xia, Mingjun; Li, R. K. A terbium rich orthoborate LiSrTb2(BO3)3and its analogues New J. Chem., 2015, 39, 9389 |
| 7058622 | CIF | B36 H68 K8 O145 V24 | C 1 2/c 1 | 20.5946; 17.0697; 19.444 90; 92.231; 90 | 6830.2 | Hermosilla-Ibáñez, Patricio; Wrighton-Araneda, Kerry; Scarpetta-Pizo, Laura; Cañón-Mancisidor, Walter; Gutierrez-Cutiño, Marlen; Le Fur, Eric; Paredes-Garcia, Veronica; Venegas-Yazigi, Diego The origin of the electronic transitions of mixed valence polyoxovanadoborates [V12B18O60]. From an experimental and theoretical understanding. New Journal of Chemistry, 2019 |
| 7058623 | CIF | B36 K18 O159 V24 | C 1 2/c 1 | 22.469; 18.076; 16.8452 90; 98.239; 90 | 6771.1 | Hermosilla-Ibáñez, Patricio; Wrighton-Araneda, Kerry; Scarpetta-Pizo, Laura; Cañón-Mancisidor, Walter; Gutierrez-Cutiño, Marlen; Le Fur, Eric; Paredes-Garcia, Veronica; Venegas-Yazigi, Diego The origin of the electronic transitions of mixed valence polyoxovanadoborates [V12B18O60]. From an experimental and theoretical understanding. New Journal of Chemistry, 2019 |
| 7062967 | CIF | B4 H16 Hf | P -4 3 m | 5.946; 5.946; 5.946 90; 90; 90 | 210.2 | Burkmann, Konrad; Habermann, Franziska; Schumann, Erik; Kraus, Jakob; Störr, Bianca; Schmidt, Horst; Brendler, Erica; Seidel, Jürgen; Bohmhammel, Klaus; Kortus, Jens; Mertens, Florian Structural and thermodynamic investigations of Zr(BH4)4 and Hf(BH4)4 between 280 K and their decomposition temperatures New Journal of Chemistry, 2024, 48, 2743-2754 |
| 7062966 | CIF | B4 H16 Zr | P -4 3 m | 5.955; 5.955; 5.955 90; 90; 90 | 211.2 | Burkmann, Konrad; Habermann, Franziska; Schumann, Erik; Kraus, Jakob; Störr, Bianca; Schmidt, Horst; Brendler, Erica; Seidel, Jürgen; Bohmhammel, Klaus; Kortus, Jens; Mertens, Florian Structural and thermodynamic investigations of Zr(BH4)4 and Hf(BH4)4 between 280 K and their decomposition temperatures New Journal of Chemistry, 2024, 48, 2743-2754 |
| 7058576 | CIF | B4 H4 K2 O9 | P b c n | 10.205; 6.629; 12.045 90; 90; 90 | 814.8 | Shi, Tingting; Zhang, Fangfang; Tudi, Abudukadi; Yang, Zhihua; Pan, Shilie K2[B4O5(OH)4]·H2O and K2[B4O5(OH)4]: two new hydrated potassium borates with isolated [B4O5(OH)4]2− units and different structural frameworks New Journal of Chemistry, 2019, 43, 11660 |
| 7058577 | CIF | B4 H6 K2 O10 | P -1 | 7.1689; 7.8464; 8.9736 68.583; 88.338; 74.86 | 452.36 | Shi, Tingting; Zhang, Fangfang; Tudi, Abudukadi; Yang, Zhihua; Pan, Shilie K2[B4O5(OH)4]·H2O and K2[B4O5(OH)4]: two new hydrated potassium borates with isolated [B4O5(OH)4]2− units and different structural frameworks New Journal of Chemistry, 2019, 43, 11660 |
| 7055226 | CIF | B5 Ca3 Nd3 O15 | P 63 m c | 10.4864; 10.4864; 6.2665 90; 90; 120 | 596.772 | Wang, Xing; Xia, Mingjun; Li, R. K. Two potential self-activated orthoborates Cd4NdO(BO3)3and Ca3Nd3(BO3)5: growth, crystal structures and optical properties New J. Chem., 2016, 40, 2057 |
| 7060355 | CIF | B5 Gd O10 Zn | P 1 21/n 1 | 8.5905; 7.5936; 9.3872 90; 93.398; 90 | 611.28 | Ma, Qin; Tong, Tinghao; Su, Zhi Synthesis, crystal structure and theoretical calculations of two rare-earth borates with DUV cut-off edges New Journal of Chemistry, 2021, 45, 4823-4827 |
| 7060356 | CIF | B5 O10 Y Zn | P 1 21/n 1 | 8.518; 7.5935; 9.3523 90; 93.755; 90 | 603.62 | Ma, Qin; Tong, Tinghao; Su, Zhi Synthesis, crystal structure and theoretical calculations of two rare-earth borates with DUV cut-off edges New Journal of Chemistry, 2021, 45, 4823-4827 |
| 7060261 | CIF | B6 F2 K Na O9 | P 1 21/c 1 | 9.274; 10.062; 11.598 90; 126.54; 90 | 869.5 | Chen, Zilong; Feng, Junwei; Dai, Bin; Yu, Feng NaKB6O9F2: a new complex alkali metal fluorooxoborate with puckered layers New Journal of Chemistry, 2021, 45, 2974-2980 |
| 7062379 | CIF | B6 O12 Sr Zn2 | P -1 | 6.5206; 6.5408; 11.4026 79.29; 83.151; 61.048 | 417.89 | Long, Xiangyu; Lv, Yan; Wu, Xueyan Discovery of SrZn2B6O12 with an unprecedented quadruple-layered configuration New Journal of Chemistry, 2023, 47, 6041-6044 |
| 7058492 | CIF | B8 Ba4 Li3 O22 Sc3 | P -1 | 9.7959; 10.2519; 11.5878 85.069; 68.734; 62.795 | 960.02 | Meng, Xianghe; Xia, Mingjun; Li, Rukang Li3Ba4Sc3(BO3)4(B2O5)2: featuring the coexistence of isolated BO3 and B2O5 units New Journal of Chemistry, 2019, 43, 11469 |
| 7062333 | CIF | Ba Ce Cu S3 | P n m a | 10.674; 4.12; 13.409 90; 90; 90 | 589.69 | Shahid, Omair; Yadav, Sweta; Maity, Debanjan; Deepa, Melepurath; Niranjan, Manish K.; Prakash, Jai Synthesis, crystal structure, DFT, and photovoltaic studies of BaCeCuS3 New Journal of Chemistry, 2023, 47, 5378-5389 |
| 7057771 | CIF | Ba Cl Cu H3 O3 | P 1 21/m 1 | 4.1335; 6.674; 9.1613 90; 100.43; 90 | 248.56 | Wang, Ming-Qing; Huang, Ya-Xi; Pan, Yuanming; Mi, Jin-Xiao BaCu(OH)3Cl: a new one-dimensional Mott insulator with a CuO2 chessboard layer New Journal of Chemistry, 2018, 42, 18077 |
| 7060927 | CIF | Ba Cl N O3 | P n m a | 8.9108; 5.2991; 8.3414 90; 90; 90 | 393.87 | Chen, Zhen; Zeng, Hao; Han, Shujuan; Yang, Zhihua; Pan, Shilie From BaCl2 to Ba(NO3)Cl: significantly enhanced birefringence derived from π-conjugated [NO3] New Journal of Chemistry, 2021, 45, 17544-17550 |
| 7061574 | CIF | Ba H I3 O9 | P 1 21/c 1 | 7.777; 8; 13.79 90; 92.803; 90 | 856.9 | Ma, Wenjuan; Huang, Jianlong; Dai, Bin; Yu, Feng BaI3O9H: a new alkaline-earth metal hydroxy iodate with two groups New Journal of Chemistry, 2022, 46, 12482-12487 |
| 7057343 | CIF | Ba H6 N4 O11 Pt | P -1 | 8.3841; 8.422; 9.5643 81.036; 71.001; 60.479 | 555.65 | Zadesenets, Andrey V.; Filatov, Evgeniy Yu.; Plyusnin, Pavel E.; Asanova, Tatyana I.; Korolkov, Ilya V.; Baidina, Iraida A.; Shlyakhova, Elena V.; Asanov, Igor P.; Korenev, Sergey V. Complex salts of Pd(ii) and Pt(ii) with Co(ii) and Ni(ii) aqua-cations as single-source precursors for bimetallic nanoalloys and mixed oxides New Journal of Chemistry, 2018, 42, 8843 |
| 7062526 | CIF | Ba O17 U4 | P -1 | 4.232; 8.199; 10.649 87.4; 78.53; 75.01 | 349.79 | Lu, Kimbal T.; Zhang, Yingjie; Wei, Tao; Ablott, Timothy A.; Plášil, Jakub; Karatchevtseva, Inna; Zheng, Rongkun Investigation of uranium oxide hydrates with barium(ii) ions: structural diversity, uranium valences and implications New Journal of Chemistry, 2023, 47, 13286-13296 |
| 7056078 | CIF | Ba O6 Pb Si2 | C m c m | 5.5092; 15.45; 7.287 90; 90; 90 | 620.2 | Dong, Lingyun; Jia, Liangliang; Wang, Lijun New lead(II) borates in the PbO/PbF2/H3BO3 ternary phase diagram: syntheses and structures of β-Pb6B10O21 and Pb4B8O16 New J. Chem., 2017 |
| 7056920 | CIF | Ba1.75 Li0.5 S4 Sn | I -4 3 d | 14.577; 14.577; 14.577 90; 90; 90 | 3097.5 | Abudurusuli, Ailijiang; Wu, Kui; Pan, Shilie Four new quaternary chalcogenides A2Ba7Sn4Q16 (A = Li, Na; Q = S, Se): syntheses, crystal structures determination, nonlinear optical performances investigation New Journal of Chemistry, 2018, 42, 3350 |
| 7056918 | CIF | Ba1.75 Li0.5 Se4 Sn | I -4 3 d | 15.1628; 15.1628; 15.1628 90; 90; 90 | 3486.1 | Abudurusuli, Ailijiang; Wu, Kui; Pan, Shilie Four new quaternary chalcogenides A2Ba7Sn4Q16 (A = Li, Na; Q = S, Se): syntheses, crystal structures determination, nonlinear optical performances investigation New Journal of Chemistry, 2018, 42, 3350 |
| 7056917 | CIF | Ba1.75 Na0.5 S4 Sn | I -4 3 d | 14.807; 14.807; 14.807 90; 90; 90 | 3246.4 | Abudurusuli, Ailijiang; Wu, Kui; Pan, Shilie Four new quaternary chalcogenides A2Ba7Sn4Q16 (A = Li, Na; Q = S, Se): syntheses, crystal structures determination, nonlinear optical performances investigation New Journal of Chemistry, 2018, 42, 3350 |
| 7056919 | CIF | Ba1.75 Na0.5 Se4 Sn | I -4 3 d | 15.4163; 15.4163; 15.4163 90; 90; 90 | 3663.9 | Abudurusuli, Ailijiang; Wu, Kui; Pan, Shilie Four new quaternary chalcogenides A2Ba7Sn4Q16 (A = Li, Na; Q = S, Se): syntheses, crystal structures determination, nonlinear optical performances investigation New Journal of Chemistry, 2018, 42, 3350 |
| 7056079 | CIF | Ba2 O10 Pb S Si2 | P n m a | 7.252; 5.4841; 24.352 90; 90; 90 | 968.5 | Dong, Lingyun; Jia, Liangliang; Wang, Lijun New lead(II) borates in the PbO/PbF2/H3BO3 ternary phase diagram: syntheses and structures of β-Pb6B10O21 and Pb4B8O16 New J. Chem., 2017 |
| 7062527 | CIF | Ba2 O40.5 U11 | C 1 2/c 1 | 13.251; 10.389; 25.13 90; 90.33; 90 | 3459.5 | Lu, Kimbal T.; Zhang, Yingjie; Wei, Tao; Ablott, Timothy A.; Plášil, Jakub; Karatchevtseva, Inna; Zheng, Rongkun Investigation of uranium oxide hydrates with barium(ii) ions: structural diversity, uranium valences and implications New Journal of Chemistry, 2023, 47, 13286-13296 |
| 7061236 | CIF | Ba4 Bi3 Na O12 | P -1 | 8.5415; 8.5421; 8.5441 89.996; 89.995; 90.016 | 623.4 | Hossain, Khandaker Monower; Saiduzzaman, Md; Kumada, Nobuhiro; Takei, Takahiro; Yamane, Hisanori Hydrothermal synthesis and crystal structure of a novel double-perovskite-type bismuth oxide with 3 : 1 ordering at the B-site New Journal of Chemistry, 2022, 46, 3595-3601 |
| 7063074 | CIF | Ba5 O40 Si8 Y12 Zn | I -4 2 m | 18.7014; 18.7014; 5.364 90; 90; 90 | 1876.02 | Ababaikeri, Aihaimaitijiang; Pan, Xueting; Tuniyazi, Gulimeikereyi; Jiang, Xiangzhan; Zhang, Yanhui; Malik, Dilnur Ba5Y12Zn[O(SiO4)]8: a novel non-centrosymmetric silicate with a short ultraviolet cut-off edge featuring [ZnSi4O16] and [SiO4] units New Journal of Chemistry, 2024, 48, 3594-3602 |
| 7058489 | CIF | Bi Na2 S4 Sb | F m -3 m | 5.7603; 5.7603; 5.7603 90; 90; 90 | 191.13 | Alahmari, Fatimah; Dey, Somnath; Emwas, Abdul-Hamid; Davaasuren, Bambar; Rothenberger, Alexander Ultra-low thermal conductivity in Na/Sb chalcobismuthates: synthesis, crystal structures, optical properties and 23Na NMR spectroscopy New Journal of Chemistry, 2019, 43, 10814 |
| 7058490 | CIF | Bi Na2 Sb Se4 | F m -3 m | 5.9648; 5.9648; 5.9648 90; 90; 90 | 212.22 | Alahmari, Fatimah; Dey, Somnath; Emwas, Abdul-Hamid; Davaasuren, Bambar; Rothenberger, Alexander Ultra-low thermal conductivity in Na/Sb chalcobismuthates: synthesis, crystal structures, optical properties and 23Na NMR spectroscopy New Journal of Chemistry, 2019, 43, 10814 |
| 7058491 | CIF | Bi Na2 Sb Te4 | F m -3 m | 6.3315; 6.3315; 6.3315 90; 90; 90 | 253.82 | Alahmari, Fatimah; Dey, Somnath; Emwas, Abdul-Hamid; Davaasuren, Bambar; Rothenberger, Alexander Ultra-low thermal conductivity in Na/Sb chalcobismuthates: synthesis, crystal structures, optical properties and 23Na NMR spectroscopy New Journal of Chemistry, 2019, 43, 10814 |
| 7062548 | CIF | Bi0.75 O1.75 V0.25 | P -1 | 5.7337; 7.1029; 9.298 80.334; 78.576; 68.557 | 343.58 | Shvanskaya, Larisa; Krikunova, Polina; Nikolaeva, Irina; Lyssenko, Konstantin; Pokryshkin, Nikolay; Timoshenko, Victor Novel bismuth oxosalts, β-Bi3O3(VO4) and KBi5O5(PO4)2: synthesis and effect of hydrothermal pressure on the crystal structure New Journal of Chemistry, 2023, 47, 13911-13917 |
| 7063147 | CIF | Bi2.49 Cl Na2.51 O12 P3 | P -6 | 9.7197; 9.7197; 13.8019 90; 90; 120 | 1129.21 | Belokoneva, Elena L.; Volkov, Anatoly S.; Dimitrova, Olga V.; Stefanovich, Sergey Yu.; Govorko, Nadezhda B. Hydrothermally synthesized first acentric apatite (Bi5Na5)[PO4]6Cl2 with wide Bi–Na isomorphism and doubled c-axis New Journal of Chemistry, 2024, 48, 7940-7945 |
| 7062547 | CIF | Bi2.5 K0.5 O6.5 P | P 1 21/c 1 | 8.0264; 5.4616; 27.769 90; 95.697; 90 | 1211.3 | Shvanskaya, Larisa; Krikunova, Polina; Nikolaeva, Irina; Lyssenko, Konstantin; Pokryshkin, Nikolay; Timoshenko, Victor Novel bismuth oxosalts, β-Bi3O3(VO4) and KBi5O5(PO4)2: synthesis and effect of hydrothermal pressure on the crystal structure New Journal of Chemistry, 2023, 47, 13911-13917 |
| 7050458 | CIF | C Cl2 O S | P 1 21/c 1 | 6.034; 10.311; 7.226 90; 99.72; 90 | 443.1 | Romano, Rosana M.; Della Védova, Carlos O.; Downs, Anthony J.; Parsons, Simon; Smith, Caroline Structural and vibrational properties of ClC(O)SY compounds with Y = Cl and CH3 New Journal of Chemistry, 2003, 27, 514 |
| 7054164 | CIF | C Fe N2 | P 63/m m c | 3.2689; 3.2689; 9.4008 90; 90; 120 | 86.996 | Herlitschke, M.; Tchougréeff, A. L.; Soudackov, A. V.; Klobes, B.; Stork, L.; Dronskowski, R.; Hermann, R. P. Magnetism and lattice dynamics of FeNCN compared to FeO New J. Chem., 2014, 38, 4670 |
| 7058832 | CIF | C H Cd N O Zn | P -1 | 8.3924; 11.0752; 16.47 97.593; 92.113; 112.088 | 1399.8 | Akhtaruzzaman, Akhtaruzzaman; Das, Pubali; Khan, Samim; Maity, Suvendu; Naaz, Sanobar; Islam, Sakhiul; Ghosh, Prasanta; Ray, Partha Pratim; Mir, Mohammad Hedayetullah Two zinc(ii)-based coordination polymers with flexible dicarboxylate and pyridine mixed ligands: effect of π⋯π interactions on electrical activity New Journal of Chemistry, 2019, 43, 16071 |
| 7060963 | CIF | C H Cl N O S | P -1 | 10.44; 11.519; 12.207 112.745; 91.875; 106.279 | 1282.9 | Singh, Vedeshwar Narayan; Sharma, Sitaram The facile and efficient synthesis of novel monocyclic cis-β-lactam conjugates with a 1-methyl-1H-imidazole-2-thiol nucleus New Journal of Chemistry, 2021, 45, 19347-19357 |
| 7062713 | CIF | C H Cl0.04 Co Cu0.04 N O | P 1 21/c 1 | 9.0804; 20.1924; 11.897 90; 91.264; 90 | 2180.8 | Chaudhary, Virendra Kumar; Singh, Sain; Kumar, Kapil; Choudhury, Angshuman R.; Ghosh, Kaushik Facile synthesis of benzoxazole derivatives by a multi-component reaction catalysed by copper complexes capable of generating phenoxyl radical complex New Journal of Chemistry, 2023, 47, 18995-19004 |
| 7062541 | CIF | C H Fe N O | P -1 | 13.17; 13.176; 13.207 60.41; 60.41; 60.46 | 1636.17 | Das, Jayanta; Maji, Sangita; Mandal, Prasenjit; Ghosh, Subhasis; Das, Debasis A tripodal imine-derived Fe(iii) complex for the fluorescence recognition of Mg(ii) via green emission: crystal structure, photophysical interactions and DFT studies New Journal of Chemistry, 2023, 47, 13776-13782 |
| 7061479 | CIF | C H N | P -1 | 8.036; 10.55; 13.26 93.56; 96.81; 94.96 | 1109 | De, Rimpa; Sengupta, Utsav; Savarimuthu, Antony; Misra, Souvik; Nanda, Jayanta; Bera, Mrinal K. A practical and cost-effective approach to polysubstituted pyrimidine derivatives via DBU mediated redox isomerization of propargyl alcohol and subsequent N–C–N fragment condensation New Journal of Chemistry, 2022, 46, 10603-10610 |
| 7053853 | CIF | C H N O | P 21 21 21 | 7.5322; 16.363; 24.127 90; 90; 90 | 2973.6 | Yao, Guiyang; Li, Yajun; Zhu, Yongtao; Pan, Yingming; Huang, Fuping; Wang, Hengshan; Liao, Zhixin Protonation-controlled axial chirality in maleopimaric imides New Journal of Chemistry, 2014, 38, 693 |
| 7058179 | CIF | C H N O | P 1 21 1 | 9.4628; 10.1211; 10.7468 90; 108.784; 90 | 974.4 | Konda, Maruthi; Ghosh, Tapas; Mobin, Shaikh M.; Das, Apurba K. Intertwined gababutin-based supramolecular double helix New Journal of Chemistry, 2019, 43, 4830 |
| 7057751 | CIF | C H N O S | P -1 | 9.563; 10.201; 16.616 89.822; 89.865; 76.378 | 1575 | Liu, Zengchen; Yang, Weijie; Tian, Boshi; Liu, Jin; Zhu, Wenping; Ge, Genwu; Xiao, Lina; Meng, Yuning Fabrication of a self-assembled supramolecular fluorescent nanosensor from functional graphene oxide and its application for the detection of Al3+ New Journal of Chemistry, 2018, 42, 17665 |
| 7060962 | CIF | C H N O S | P -1 | 10.3342; 11.9217; 12.426 115.186; 111.605; 92.28 | 1252.4 | Singh, Vedeshwar Narayan; Sharma, Sitaram The facile and efficient synthesis of novel monocyclic cis-β-lactam conjugates with a 1-methyl-1H-imidazole-2-thiol nucleus New Journal of Chemistry, 2021, 45, 19347-19357 |
| 7051604 | CIF | C H N5 O2 | P 1 21 1 | 5.3358; 9.4799; 8.319 90; 106.989; 90 | 402.44 | Klapötke, Thomas M.; Sabaté, Carles Miró; Stierstorfer, Jörg Neutral 5-nitrotetrazoles: easy initiation with low pollution New Journal of Chemistry, 2009, 33, 136 |
| 7055455 | CIF | C H O | P b c a | 7.615; 23.48; 36.26 90; 90; 90 | 6483 | Wang, Xiu-Zhen; Yang, Hui-Hui; Li, Wei; Han, Bing-Jie; Liu, Yun-Jun Studies on apoptosis in HeLa cells via the ROS-mediated mitochondrial pathway induced by new dibenzoxanthenes New J. Chem., 2016, 40, 5255 |
| 7051804 | CIF | C H2 N4 O5 | F d d 2 | 12.0015; 17.6425; 4.5555 90; 90; 90 | 964.57 | Ye, Chengfeng; Gao, Haixiang; Twamley, Brendan; Shreeve, Jean’ne M. Dense energetic salts of N,N′-dinitrourea (DNU) New Journal of Chemistry, 2008, 32, 317 |
| 7059326 | CIF | C H38 B24 K15 N2 Na O68 | P -6 2 c | 11.1399; 11.1399; 30.495 90; 90; 120 | 3277.3 | Cao, Yuchen; Zhang, Bingbing; Liu, Hongkun; Li, Danni; Wang, Ying NaK15[B4O5(OH)4]6(NO2)2(CO3)·7H2O: assembly of an unprecedented mixed anion inorganic compound via a facile hydrothermal route New Journal of Chemistry, 2020, 44, 4253-4256 |
| 7050392 | CIF | C H5 B9 Br5 Cs | P 4/n m m :2 | 8.3873; 8.3873; 10.5853 90; 90; 90 | 744.64 | Andreas Franken; Neil J. Bullen; Tomáš Jelínek; Mark Thornton-Pett; Simon J. Teat; William Clegg; John D. Kennedy; Michaele J. Hardie Structural chemistry of halogenated monocarbaboranes: the extended structures of Cs[1-HCB9H4Br5], Cs[1-HCB11H5Cl6] and Cs[1-HCB11H5Br6] New J. Chem., 2004, 28, 1499-1505 |
| 7053975 | CIF | C H5 N5 O6 | P 1 21/n 1 | 8.0012; 11.8726; 14.0979 90; 104.441; 90 | 1296.92 | Joo, Young-Hyuk; Min, Byoung Sun Denitration of hydrazinium nitroformate to form hydrazinium dinitromethanide New Journal of Chemistry, 2014, 38, 50 |
| 7050393 | CIF | C H6 B11 Br6 Cs | P 1 2/c 1 | 15.0967; 9.246; 12.5568 90; 97.112; 90 | 1739.24 | Andreas Franken; Neil J. Bullen; Tomáš Jelínek; Mark Thornton-Pett; Simon J. Teat; William Clegg; John D. Kennedy; Michaele J. Hardie Structural chemistry of halogenated monocarbaboranes: the extended structures of Cs[1-HCB9H4Br5], Cs[1-HCB11H5Cl6] and Cs[1-HCB11H5Br6] New J. Chem., 2004, 28, 1499-1505 |
| 7052512 | CIF | C H6 B11 Cl6 Cs | P 1 2/c 1 | 14.5462; 8.8913; 12.2784 90; 97.01; 90 | 1576.15 | Andreas Franken; Neil J. Bullen; Tomáš Jelínek; Mark Thornton-Pett; Simon J. Teat; William Clegg; John D. Kennedy; Michaele J. Hardie Structural chemistry of halogenated monocarbaboranes: the extended structures of Cs[1-HCB9H4Br5], Cs[1-HCB11H5Cl6] and Cs[1-HCB11H5Br6] New J. Chem., 2004, 28, 1499-1505 |
| 7051493 | CIF | C H6 N2 O2 S | P -1 | 5.427; 5.828; 7.649 91.97; 95.84; 107.41 | 229.1 | Structure and Vibrational Spectroscopy of Methanesulfonic Acid Hydrazide: an Experimental and Theoretical Study New Journal of Chemistry, 1999 |
| 7053976 | CIF | C H6 N4 O4 | P 1 21/n 1 | 3.701; 13.875; 10.753 90; 98.833; 90 | 545.6 | Joo, Young-Hyuk; Min, Byoung Sun Denitration of hydrazinium nitroformate to form hydrazinium dinitromethanide New Journal of Chemistry, 2014, 38, 50 |
| 7050269 | CIF | C H7 N2 O5 P | P b c a | 7.4613; 8.9753; 17.5018 90; 90; 90 | 1172.05 | Andrew Parkin; Suzanne M. Harte; Andrés E. Goeta; Chick C. Wilson Imaging proton migration from X-rays and neutrons New J. Chem., 2004, 28, 718-721 |
| 7050270 | CIF | C H7 N2 O5 P | P b c a | 7.4667; 8.9827; 17.5438 90; 90; 90 | 1176.68 | Andrew Parkin; Suzanne M. Harte; Andrés E. Goeta; Chick C. Wilson Imaging proton migration from X-rays and neutrons New J. Chem., 2004, 28, 718-721 |
| 7052508 | CIF | C H7 N2 O5 P | P b c a | 7.472; 8.9926; 17.5962 90; 90; 90 | 1182.34 | Andrew Parkin; Suzanne M. Harte; Andrés E. Goeta; Chick C. Wilson Imaging proton migration from X-rays and neutrons New J. Chem., 2004, 28, 718-721 |
| 7052509 | CIF | C H7 N2 O5 P | P b c a | 7.4858; 9.0041; 17.6597 90; 90; 90 | 1190.31 | Andrew Parkin; Suzanne M. Harte; Andrés E. Goeta; Chick C. Wilson Imaging proton migration from X-rays and neutrons New J. Chem., 2004, 28, 718-721 |
| 7052510 | CIF | C H7 N2 O5 P | P b c a | 7.4904; 9.0176; 17.7254 90; 90; 90 | 1197.27 | Andrew Parkin; Suzanne M. Harte; Andrés E. Goeta; Chick C. Wilson Imaging proton migration from X-rays and neutrons New J. Chem., 2004, 28, 718-721 |
| 7051404 | CIF | C H7 N5 O8 P2 Zn2 | P 1 21/n 1 | 8.0893; 12.7708; 10.0663 90; 105.275; 90 | 1003.2 | New Journal of Chemistry, 1999 |
| 7054253 | CIF | C10 H F11 N2 | P 21 21 21 | 5.1335; 9.1624; 24.825 90; 90; 90 | 1167.65 | Muñoz, Bianca K.; Ojo, Wilfried-Solo; Jacob, Kane; Romero, Nuria; Vendier, Laure; Despagnet-Ayoub, Emmanuelle; Etienne, Michel Perfluorinated 1H-indazoles and hydrotris(indazol-1-yl)borates. Supramolecular organization and a new synthetic procedure to form scorpionate ligands New Journal of Chemistry, 2014, 38, 2451 |
| 7053093 | CIF | C10 H10 Ag Cl N4 O4 | P 1 21/c 1 | 6.9519; 14.9904; 12.8623 90; 103.276; 90 | 1304.6 | Abul Haj, Mohammad; Aakeröy, Christer B.; Desper, John Silver(i) coordination chemistry: from 1-D chains to molecular rectangles New Journal of Chemistry, 2013, 37, 204 |
| 7053094 | CIF | C10 H10 Ag F6 N4 P | P 1 21/c 1 | 6.7927; 15.7016; 13.1938 90; 102.723; 90 | 1372.65 | Abul Haj, Mohammad; Aakeröy, Christer B.; Desper, John Silver(i) coordination chemistry: from 1-D chains to molecular rectangles New Journal of Chemistry, 2013, 37, 204 |
| 7051461 | CIF | C10 H10 Br2 N2 O3 | P -1 | 8.168; 9.279; 9.875 65.47; 80.99; 67.69 | 629.9 | Banwell, Martin, G.; Bray, Andrew M.; Willis, Anthony C.; Wong, David J. First Syntheses of the Pyrroloketopiperazine Marine Natural Products (±)-Longamide, (±)-Longamide B Methyl Ester and and (±)-Hanishin. New Journal of Chemistry, 1999 |
| 7058145 | CIF | C10 H10 Br6 Cl2 N2 Te | P -1 | 7.3223; 8.3339; 9.0497 74.694; 70.263; 83.031 | 501.05 | Shayapov, Vladimir R.; Usoltsev, Andrey N.; Adonin, Sergey A.; Sokolov, Maxim N.; Samsonenko, Denis G.; Fedin, Vladimir P. Thermochromism of bromotellurates(iv): experimental insights New Journal of Chemistry, 2019, 43, 3927 |
| 7061530 | CIF | C10 H10 Cl N O4 Zn | I 41/a :2 | 23.2647; 23.2647; 9.6364 90; 90; 90 | 5215.7 | Yan, Li; Li, Zhongkui; Xiong, Yan; Zhong, Xue; Peng, Shaochun; Li, Hui Zinc(ii) Schiff base complexes as dual probes for the detection of NH4+ and HPO42− ions New Journal of Chemistry, 2022, 46, 12910-12917 |
| 7062609 | CIF | C10 H10 Cl2 F N3 O Ru | C 1 2/c 1 | 7.343; 14.561; 12.347 90; 96.381; 90 | 1312 | Mikhailov, Artem A.; Brovko, Anastasiya O.; Kuratieva, Nataliya V.; Eltsov, Ilia V.; Schaniel, Dominik; Kostin, Gennadiy A. The influence of hydroxide to fluoride substitution in the trans-position to NO on the photochemistry of ruthenium nitrosyl complexes in the solid state and in solution New Journal of Chemistry, 2023, 47, 15506-15513 |
| 7052871 | CIF | C10 H10 Co F6 Sb | P 32 2 1 | 9.2135; 9.2135; 12.344 90; 90; 120 | 907.5 | Diana, Eliano; Chierotti, Michele R.; Marchese, Edoardo M. C.; Croce, Gianluca; Milanesio, Marco; Stanghellini, Pier Luigi Blue and red shift hydrogen bonds in crystalline cobaltocinium complexes New Journal of Chemistry, 2012, 36, 1099 |
| 7052870 | CIF | C10 H10 Co I | C m c m | 11.524; 9.41; 9.133 90; 90; 90 | 990.4 | Diana, Eliano; Chierotti, Michele R.; Marchese, Edoardo M. C.; Croce, Gianluca; Milanesio, Marco; Stanghellini, Pier Luigi Blue and red shift hydrogen bonds in crystalline cobaltocinium complexes New Journal of Chemistry, 2012, 36, 1099 |
| 7057978 | CIF | C10 H10 Cu F3 N3 O3 | P -1 | 6.3596; 7.6821; 14.234 102.532; 94.963; 93.215 | 674.3 | Cen, Peipei; Yuan, Weize; Luo, Shuchang; Liu, Xiangyu; Xie, Gang; Chen, Sanping Solvent coligands fine-tuned the structures and magnetic properties of triple-bridged 1D azido-copper(ii) coordination polymers New Journal of Chemistry, 2019, 43, 601 |
| 7050523 | CIF | C10 H10 Cu N10 | P 1 21/c 1 | 7.9536; 6.7856; 24.295 90; 92.585; 90 | 1309.9 | Mohamadou, Aminou; van Albada, Gerard A.; Kooijman, Huub; Wieczorek, Birgit; Spek, Anthony L.; Reedijk, Jan The binding mode of the ambidentate ligand dicyanamide to transition metal ions can be tuned by bisimidazoline ligands with H-bonding donor property at the rear side of the ligandElectronic supplementary information (ESI) available: atomic displacement plot of structure 2. See http://www.rsc.org/suppdata/nj/b2/b212059c/ New Journal of Chemistry, 2003, 27, 983 |
| 7060309 | CIF | C10 H10 F11 N3 O6 S3 | P 1 21/c 1 | 9.8011; 11.0925; 18.3728 90; 97.261; 90 | 1981.45 | Siegel, David J.; Anderson, Grace I.; Cyr, Noah; Lambrecht, Daniel S.; Zeller, Matthias; Hillesheim, Patrick C.; Mirjafari, Arsalan Molecular design principles of ionic liquids with a sulfonyl fluoride moiety New Journal of Chemistry, 2021, 45, 2443-2452 |
| 7057359 | CIF | C10 H10 F4 I2 N2 | P -1 | 6.1088; 9.4013; 12.4113 103.403; 96.182; 95.921 | 683.27 | Bedeković, Nikola; Stilinović, Vladimir; Friščić, Tomislav; Cinčić, Dominik Comparison of isomericmeta- andpara-diiodotetrafluorobenzene as halogen bond donors in crystal engineering New Journal of Chemistry, 2018, 42, 10584 |
| 7053741 | CIF | C10 H10 F6 N3 O4 S2 | C 1 c 1 | 9.7224; 10.7874; 16.19 90; 103.573; 90 | 1650.6 | Hardacre, Christopher; Holbrey, John D.; Mullan, Claire L.; Nieuwenhuyzen, Mark; Reichert, W. Matthew; Seddon, Kenneth R.; Teat, Simon J. Ionic liquid characteristics of 1-alkyl-n-cyanopyridinium and 1-alkyl-n-(trifluoromethyl)pyridinium salts New Journal of Chemistry, 2008, 32, 1953 |
| 7054126 | CIF | C10 H10 I N O5 | P 1 21/n 1 | 15.892; 4.5575; 18.335 90; 110.667; 90 | 1242.5 | Zaware, Santosh B.; Gonnade, Rajesh G.; Srinivas, Darbha; Khan, Ayesha; Rane, Sandhya Y. Antioxidant and anticancer activities of supramolecularly controlled magnetostructural halo-oximes of lawsone New Journal of Chemistry, 2011, 35, 1615 |
| 7057380 | CIF | C10 H10 I2 O2 | P 1 21/c 1 | 11.1961; 11.5073; 9.2386 90; 100.613; 90 | 1169.9 | Gamekkanda, Janaka C.; Sinha, Abhijeet S.; Desper, John; Đaković, Marijana; Aakeröy, Christer B. Competition between hydrogen bonds and halogen bonds: a structural study New Journal of Chemistry, 2018, 42, 10539 |
| 7053188 | CIF | C10 H10 N16 O11 | P 1 21/n 1 | 13.161; 13.007; 23.346 90; 100.685; 90 | 3927.2 | Dong, Kai; Wang, Yuan; Gong, Xu-Bin; Zhang, Jing; Sun, Cheng-Hui; Pang, Si-Ping Formyl azido substituted nitro hexaazaisowurtzitane ‒ synthesis, characterization and energetic properties New Journal of Chemistry, 2013, 37, 3685 |
| 7051843 | CIF | C10 H10 N2 O2 | P 1 21/c 1 | 16.1313; 5.0524; 11.8012 90; 109.906; 90 | 904.35 | Delval, Franck; Spyratou, Alexandra; Verdan, Simon; Bernardinelli, Gerald; Williams, Alan F. The clash of the synthons: crystal structures of benzimidazole‒alcohol‒carboxylic acids New Journal of Chemistry, 2008, 32, 1394 |
| 7062870 | CIF | C10 H10 N2 O2 | P 21 21 21 | 4.8051; 11.2889; 16.6472 90; 90; 90 | 903.02 | Badhani, Gaurav; Biramya, Valvi Mangesh; Adimurthy, Subbarayappa Ionic liquid-catalysed regioselective oxygenation of quinoxalin-2(1H)-ones under visible-light conditions New Journal of Chemistry, 2023, 47, 21596-21599 |
| 7051845 | CIF | C10 H10 N2 O3 | P 1 21 1 | 4.6354; 10.4827; 10.2152 90; 101.112; 90 | 487.07 | Delval, Franck; Spyratou, Alexandra; Verdan, Simon; Bernardinelli, Gerald; Williams, Alan F. The clash of the synthons: crystal structures of benzimidazole‒alcohol‒carboxylic acids New Journal of Chemistry, 2008, 32, 1394 |
| 7062932 | CIF | C10 H10 N2 O4 | P 1 21/c 1 | 4.9587; 12.6054; 16.0639 90; 96.892; 90 | 996.84 | Khan, Ishaat M.; Khan, Arshi; Shakya, Sonam; Osama, Mohammad; Islam, Maidul; Naaz, Farha; Ahmad, Musheer Investigating the binding of organic charge transfer co-crystals to human serum albumin by experimental and theoretical methods: spectroscopy, molecular docking and DFT/TD-DFT studies New Journal of Chemistry, 2024, 48, 2527-2546 |
| 7060610 | CIF | C10 H10 N2 S4 Se | P 1 21/c 1 | 8.7866; 12.3894; 12.6125 90; 94.728; 90 | 1368.3 | Le Gal, Yann; Roisnel, Thierry; Barrière, Frédéric; Mori, Takehiko; Lorcy, Dominique Diselenolene proligands: reactivity and comparison with their dithiolene congeners New Journal of Chemistry, 2021, 45, 8971-8977 |
| 7060611 | CIF | C10 H10 N2 S4 Se2 | P 1 21/n 1 | 7.9196; 8.7472; 20.8069 90; 99.984; 90 | 1419.6 | Le Gal, Yann; Roisnel, Thierry; Barrière, Frédéric; Mori, Takehiko; Lorcy, Dominique Diselenolene proligands: reactivity and comparison with their dithiolene congeners New Journal of Chemistry, 2021, 45, 8971-8977 |
| 7050273 | CIF | C10 H10 N4 O | F d d 2 | 19.001; 25.829; 7.844 90; 90; 90 | 3849.7 | Carmen Alvarez-Rua; Santiago García-Granda; Shyamaprosad Goswami; Reshmi Mukherjee; Swapan Dey; Rosa M. Claramunt; M. Dolores Santa María; Isabel Rozas; Nadine Jagerovic; Ibon Alkorta; José Elguero Multiple hydrogen bonds and tautomerism in naphthyridine derivatives New J. Chem., 2004, 28, 700-707 |
| 7057141 | CIF | C10 H10 N4 O | P c a 21 | 21.079; 4.4677; 10.0801 90; 90; 90 | 949.3 | Brink, Alice; Kroon, Robin E.; Visser, Hendrik G.; van Rensburg, Constance E. J.; Roodt, Andreas Designing model imino bifunctional chelators for radiopharmaceuticals ‒ in vitro antitumor activity, photoluminescence and structural analysis New Journal of Chemistry, 2018, 42, 5193 |
| 7056673 | CIF | C10 H10 N4 O2 | P 1 21/c 1 | 5.422; 10.436; 17.944 90; 91.2; 90 | 1015.1 | Wang, Jin-Wen; Li, Yao-Jia; Chen, Chen; Luo, Yang-Hui; Sun, Baiwang Substituent swap affect the crystal structure and properties of N-benzyl-4-amino-1, 2, 4-triazole related organic salts New J. Chem., 2017 |
| 7055883 | CIF | C10 H10 N5 O6 V | P -1 | 7.8991; 8.1586; 12.3149 74.517; 85.174; 64.596 | 690.463 | Koleša-Dobravc, Tanja; Maejima, Keiichi; Yoshikawa, Yutaka; Meden, Anton; Yasui, Hiroyuki; Perdih, Franc Vanadium and zinc complexes of 5-cyanopicolinate and pyrazine derivatives: synthesis, structural elucidation and in vitro insulino-mimetic activity study New J. Chem., 2017, 41, 735 |
| 7050194 | CIF | C10 H10 O6 | P -1 | 6.7348; 7.0518; 11.256 75.3; 73.98; 71.04 | 478 | Bickley, Jamie; Bonar-Law, Richard; McGrath, Thomas; Singh, Nirmal; Steiner, Alexander Dirhodium (ii) carboxylate complexes as building blocks. cis-Chelating dicarboxylic acids designed to bridge the dinuclear coreElectronic supplementary information (ESI) available: Tables S1 and S2. See http://www.rsc.org/suppdata/nj/b3/b310008a/ New Journal of Chemistry, 2004, 28, 425 |
| 7061311 | CIF | C10 H10.4 O2 | P -1 | 9.1365; 10.0584; 13.1688 101.064; 106.529; 104.988 | 1073.67 | Gharpure, Santosh J.; Jegadeesan, S.; Vishwakarma, Dharmendra S. Total synthesis of myristinins A–F and 3′-hydroxy-5,7-dimethoxy-4-O-2′-cycloflavan by iterative generation of o-quinone methides New Journal of Chemistry, 2022, 46, 5460-5463 |
| 7058304 | CIF | C10 H11 Br N2 | P 21 21 21 | 6.1222; 11.956; 14.361 90; 90; 90 | 1051.2 | Hua, Guoxiong; Du, Junyi; Carpenter-Warren, Cameron L.; Cordes, David B.; Slawin, Alexandra M. Z.; Woollins, J. Derek New insight into the chemistry of selenoureas: synthesis and single crystal structural study of diverse derivatives New Journal of Chemistry, 2019, 43, 7035 |
| 7056669 | CIF | C10 H11 Cl N4 O6 | P 1 n 1 | 4.419; 8.581; 17.499 90; 91.35; 90 | 663.4 | Wang, Jin-Wen; Li, Yao-Jia; Chen, Chen; Luo, Yang-Hui; Sun, Baiwang Substituent swap affect the crystal structure and properties of N-benzyl-4-amino-1, 2, 4-triazole related organic salts New J. Chem., 2017 |
| 7050697 | CIF | C10 H11 Cl2 N Pd S | P 1 21/n 1 | 8.2411; 15.2287; 19.3672 90; 90.207; 90 | 2430.59 | Fernández, Alberto; Vázquez-García, Digna; Fernández, Jesús J.; López-Torres, Margarita; Suárez, Antonio; Castro-Juiz, Samuel; Ortigueira, Juan M.; Vila, José M. Cyclopalladated compounds derived from a [C,N,S] terdentate ligand: synthesis, characterization and reactivity. Crystal and molecular structures of [Pd{2-ClC6H3C(H)NCH2CH2SMe}(Cl)] and [{Pd[2-ClC6H3C(H)NCH2CH2SMe]}2{µ-Ph2P(CH2)4PPh2}][CF3SO3]2 New Journal of Chemistry, 2002, 26, 105 |
| 7055837 | CIF | C10 H11 Cl2 N3 O2 Ru | P b c a | 14.5946; 12.2931; 14.917 90; 90; 90 | 2676.3 | Makhinya, Alexander N.; Il’in, Maxim A.; Yamaletdinov, Ruslan D.; Korolkov, Ilya V.; Baidina, Iraida A. Synthesis and crystal structure of nitrosoruthenium complexes cis-[Ru(NO)Py2Cl2(OH)] and cis-[Ru(NO)Py2Cl2(H2O)]Cl. Photoinduced transformations of cis-[Ru(NO)Py2Cl2(OH)] New J. Chem., 2016, 40, 10267 |
| 7055839 | CIF | C10 H11 Cl2 N3 O2 Ru | P 1 21/c 1 | 15.3824; 6.9222; 14.4655 90; 117.818; 90 | 1362.28 | Makhinya, Alexander N.; Il’in, Maxim A.; Yamaletdinov, Ruslan D.; Korolkov, Ilya V.; Baidina, Iraida A. Synthesis and crystal structure of nitrosoruthenium complexes cis-[Ru(NO)Py2Cl2(OH)] and cis-[Ru(NO)Py2Cl2(H2O)]Cl. Photoinduced transformations of cis-[Ru(NO)Py2Cl2(OH)] New J. Chem., 2016, 40, 10267 |
| 7057949 | CIF | C10 H11 Cl4 Cu N5 O4 S | P 1 21/c 1 | 13.8439; 11.9326; 11.6222 90; 110.322; 90 | 1800.4 | Palamarciuc, Oleg; Milunović, Miljan N. M.; Sîrbu, Angela; Stratulat, Elena; Pui, Aurel; Gligorijevic, Nevenka; Radulovic, Sinisa; Kožíšek, Jozef; Darvasiová, Denisa; Rapta, Peter; Enyedy, Eva A.; Novitchi, Ghenadie; Shova, Sergiu; Arion, Vladimir B. Investigation of the cytotoxic potential of methyl imidazole-derived thiosemicarbazones and their copper(ii) complexes with dichloroacetate as a co-ligand New Journal of Chemistry, 2019, 43, 1340 |
| 7057954 | CIF | C10 H11 Cl4 Cu N5 O4 S | P 1 21/c 1 | 10.0981; 21.8935; 17.1161 90; 106.756; 90 | 3623.4 | Palamarciuc, Oleg; Milunović, Miljan N. M.; Sîrbu, Angela; Stratulat, Elena; Pui, Aurel; Gligorijevic, Nevenka; Radulovic, Sinisa; Kožíšek, Jozef; Darvasiová, Denisa; Rapta, Peter; Enyedy, Eva A.; Novitchi, Ghenadie; Shova, Sergiu; Arion, Vladimir B. Investigation of the cytotoxic potential of methyl imidazole-derived thiosemicarbazones and their copper(ii) complexes with dichloroacetate as a co-ligand New Journal of Chemistry, 2019, 43, 1340 |
| 7056286 | CIF | C10 H11 Cl4 In N2 O | C m c m | 11.882; 16.042; 7.377 90; 90; 90 | 1406.1 | Zhang, Lijing; Bai, Fengying; Gao, Xue; Du, Ning; Xing, Yong Heng; Sun, Lixian Multifunctional Indium Complexes with Fluorescent Sensing and Selective Adsorption Dye Properties New J. Chem., 2017 |
| 7050368 | CIF | C10 H11 Cl6 O Sb | P 1 21/c 1 | 9.2849; 25.0381; 14.9209 90; 104.665; 90 | 3355.8 | Jay Kochi; Milya G. Davlieva; Sergey V. Lindeman Structural Effects of Carbon-Monoxide Coordination to Carbon Centers. p and s Bindings in Aliphatic Acyl versus Aromatic Aroyl Cations New J.Chem.(Nouv.J.Chim.), 2004 |
| 7059950 | CIF | C10 H11 Cu N O5 | P 1 21 1 | 5.8152; 19.93; 9.4998 90; 102.749; 90 | 1073.9 | Miyagawa, Yoshito; Tsatsuryan, Arshak; Haraguchi, Tomoyuki; Shcherbakov, Igor; Akitsu, Takashiro Photochemical reduction of Cr(vi) compounds by amino acid Schiff base copper complexes with a hydroxyl group and titanium oxide composites in aqueous solutions New Journal of Chemistry, 2020, 44, 16665-16674 |
| 7058937 | CIF | C10 H11 Cu N13 O8 | P n a 21 | 14.6007; 15.0584; 8.085 90; 90; 90 | 1777.6 | Stierstorfer, Joerg; Wurzenberger, Maximilian Hans Horst; Lommel, Marcus; Gruhne, Michael S.; Szimhardt, Norbert; Bissinger, Benjamin Synthesis and Comparison of Copper(II) Complexes with various N-Aminotetrazole Ligands Involving Trinitrophenol Anions New Journal of Chemistry, 2019 |
| 7058945 | CIF | C10 H11 Cu N13 O9 | P n a 21 | 15.2566; 14.7433; 8.135 90; 90; 90 | 1829.83 | Stierstorfer, Joerg; Wurzenberger, Maximilian Hans Horst; Lommel, Marcus; Gruhne, Michael S.; Szimhardt, Norbert; Bissinger, Benjamin Synthesis and Comparison of Copper(II) Complexes with various N-Aminotetrazole Ligands Involving Trinitrophenol Anions New Journal of Chemistry, 2019 |
| 7060529 | CIF | C10 H11 I2 N O3 | P -1 | 4.7279; 14.6599; 19.2246 102.236; 95.5377; 92.5611 | 1293.21 | Al-Zoubi, Raed M.; Al-Jammal, Walid K.; Al-Zoubi, Mazhar S.; McDonald, Robert; Zarour, Ahmad; Yassin, Aksam; Al-Ansari, Abdulla Copper(i)-catalyzed regioselective Ullmann-type coupling of primary carbamates and 5-substituted-1,2,3-triiodobenzenes: facile synthesis of 2,3-diiodinated N-aryl carbamates New Journal of Chemistry, 2021, 45, 8432-8439 |
| 7059346 | CIF | C10 H11 N O2 S | P 1 21/c 1 | 11.7767; 9.1218; 9.7623 90; 106.287; 90 | 1006.6 | Channar, Pervaiz Ali; Saeed, Aamer; Larik, Fayaz Ali; Flörke, Ulrich; El-Seedi, Hesham; Rodríguez Pirani, Lucas S.; Erben, Mauricio F. An intramolecular 1,5-chalcogen bond on the conformational preference of carbonyl thiocarbamate species New Journal of Chemistry, 2020, 44, 5243-5253 |
| 7062551 | CIF | C10 H11 N O5 | P -1 | 6.4414; 11.785; 13.959 92.212; 96.911; 94.926 | 1046.8 | Nguyen Tran, Anh Thu; Wu, Zhiyuan; Chung, Duy T. M.; Nalaoh, Phattananawee; Lindsey, Jonathan S. Synthesis of model southern rim structures of photosynthetic tetrapyrroles and phyllobilins New Journal of Chemistry, 2023, 47, 13626-13637 |
| 7057754 | CIF | C10 H11 N3 O2 S | P n m a | 19.8951; 6.7525; 8.0436 90; 90; 90 | 1080.59 | Ramezanpour, Sorour; Rezaei, Mohammad Nasim; Vaezghaemi, Aref; Rominger, Frank Facile synthesis of novel 3,4,5-trisubstituted-1,2,4-triazin-6(1H)-ones via a sequential Ugi‒Smiles type/nucleophilic substitution/cyclization reaction New Journal of Chemistry, 2018, 42, 17533 |
| 7058097 | CIF | C10 H11 N3 O2 S | P b c a | 9.7216; 10.6601; 22.1772 90; 90; 90 | 2298.29 | Todorov, Petar T.; Peneva, Petia N.; Georgieva, Stela I.; Rusew, Rusi I.; Shivachev, Boris L.; Georgiev, Anton H. Photochromic and molecular switching behaviour of new Schiff bases containing hydantoin rings: synthesis, characterization and crystal structures New Journal of Chemistry, 2019, 43, 2740 |
| 7056667 | CIF | C10 H11 N5 O5 | P 1 21/c 1 | 8.8062; 17.518; 8.1176 90; 103.15; 90 | 1219.4 | Wang, Jin-Wen; Li, Yao-Jia; Chen, Chen; Luo, Yang-Hui; Sun, Baiwang Substituent swap affect the crystal structure and properties of N-benzyl-4-amino-1, 2, 4-triazole related organic salts New J. Chem., 2017 |
| 7056668 | CIF | C10 H11 N5 O5 | P 1 n 1 | 4.2; 8.507; 17.069 90; 94.05; 90 | 608.3 | Wang, Jin-Wen; Li, Yao-Jia; Chen, Chen; Luo, Yang-Hui; Sun, Baiwang Substituent swap affect the crystal structure and properties of N-benzyl-4-amino-1, 2, 4-triazole related organic salts New J. Chem., 2017 |
| 7059773 | CIF | C10 H12 Au2 Br2 N4 | P -1 | 7.3655; 9.5071; 14.007 71.099; 84.673; 68.279 | 861.7 | Jääskeläinen, Sirpa; Koshevoy, Igor O.; Suvanto, Sari; Ryhänen, Tiina; Hirva, Pipsa Vinylimidazole coordination modes to Pt and Au metal centers New Journal of Chemistry, 2020, 44, 12762-12770 |
| 7050683 | CIF | C10 H12 B Cu F4 N2 O | P n a 21 | 15.08; 9.895; 8.7 90; 90; 90 | 1298 | Naskar, Jnan P.; Chowdhury, Shubhamoy; Drew, Michael G. B.; Datta, Dipankar Chemistry of the copper(I)‒water bond. Some new observations New Journal of Chemistry, 2002, 26, 170 |
| 7054387 | CIF | C10 H12 B F2 N O | P 1 21/c 1 | 6.9487; 12.624; 11.3238 90; 93.457; 90 | 991.5 | Guieu, Samuel; Cardona, Francisco; Rocha, João; Silva, Artur M. S. Luminescent bi-metallic fluoroborate derivatives of bulky salen ligands New J. Chem., 2014, 38, 5411 |
| 1551261 | CIF | C10 H12 Br N3 O3 S | C 1 2/c 1 | 14.2076; 12.707; 15.2817 90; 92.703; 90 | 2755.8 | de Moura Oliveira, Carlos H.; C. de Melo, Cristiane; Doriguetto, Antonio C. Sulfamethoxazole salts: crystal structures, conformations and solubility New Journal of Chemistry, 2019, 43, 10250 |
| 7060093 | CIF | C10 H12 Br2 | P 1 21/n 1 | 8.2203; 14.6643; 9.438 90; 110.312; 90 | 1066.96 | Huynh, Huu-Tri; Jeannin, Olivier; Aubert, Emmanuel; Espinosa, Enrique; Fourmigué, Marc Chalcogen bonding interactions in chelating, chiral bis(selenocyanates) New Journal of Chemistry, 2021, 45, 76-84 |
| 7051171 | CIF | C10 H12 Br4 Cu N2 | C 1 2/c 1 | 8.162; 14.249; 13.862 90; 94.77; 90 | 1606.6 | Luque, Antonio; Sertucha, Jon; Castillo, Oscar; Román, Pascual Crystal packing and physical properties of pyridinium tetrabromocuprate(II) complexes assembled via hydrogen bonds and aromatic stacking interactions New Journal of Chemistry, 2001, 25, 1208 |
| 7058146 | CIF | C10 H12 Br6 Cl4 N2 O2 Te | P 1 21/n 1 | 8.6178; 12.9085; 10.8436 90; 98.779; 90 | 1192.14 | Shayapov, Vladimir R.; Usoltsev, Andrey N.; Adonin, Sergey A.; Sokolov, Maxim N.; Samsonenko, Denis G.; Fedin, Vladimir P. Thermochromism of bromotellurates(iv): experimental insights New Journal of Chemistry, 2019, 43, 3927 |
| 7060590 | CIF | C10 H12 Cl N O2 | P 1 21/c 1 | 16.7686; 5.065; 12.2716 90; 109.705; 90 | 981.23 | Kordestani, Nazanin; Amiri Rudbari, Hadi; Correia, Isabel; Valente, Andreia; Côrte-Real, Leonor; Islam, Mohammad Khairul; Micale, Nicola; Braun, Jason D.; Herbert, David E.; Tumanov, Nikolay; Wouters, Johan; Enamullah, Mohammed Heteroleptic enantiopure Pd(ii)-complexes derived from halogen-substituted Schiff bases and 2-picolylamine: synthesis, experimental and computational characterization and investigation of the influence of chirality and halogen atoms on the anticancer activity New Journal of Chemistry, 2021, 45, 9163-9180 |
| 7055838 | CIF | C10 H12 Cl3 N3 O2 Ru | P b c a | 12.4068; 14.0336; 16.9426 90; 90; 90 | 2949.91 | Makhinya, Alexander N.; Il’in, Maxim A.; Yamaletdinov, Ruslan D.; Korolkov, Ilya V.; Baidina, Iraida A. Synthesis and crystal structure of nitrosoruthenium complexes cis-[Ru(NO)Py2Cl2(OH)] and cis-[Ru(NO)Py2Cl2(H2O)]Cl. Photoinduced transformations of cis-[Ru(NO)Py2Cl2(OH)] New J. Chem., 2016, 40, 10267 |
| 7054023 | CIF | C10 H12 Cu N4 O4 | P 1 21/n 1 | 7.2518; 8.3493; 20.456 90; 90.762; 90 | 1238.45 | Świtlicka-Olszewska, Anna; Machura, Barbara; Mroziński, Jerzy; Kalińska, Bożena; Kruszynski, Rafał; Penkala, Mateusz Effect of N-donor ancillary ligands on structural and magnetic properties of oxalate copper(ii) complexes New Journal of Chemistry, 2014, 38, 1611 |
| 7050116 | CIF | C10 H12 I N O6 S | P 1 | 7.5196; 8.1049; 11.426 101.53; 96.26; 100.54 | 663.1 | Koposov, Alexey Y.; Nemykin, Victor N.; Zhdankin, Viktor V. Intra- and intermolecular interactions in the solid state structure of 2-iodylbenzenesulfonamides: a heptacoordinated organic iodine(v) compound New Journal of Chemistry, 2005, 29, 998 |
| 7057378 | CIF | C10 H12 I2 O3 | P 42/m | 8.5167; 8.5167; 8.8404 90; 90; 90 | 641.23 | Gamekkanda, Janaka C.; Sinha, Abhijeet S.; Desper, John; Đaković, Marijana; Aakeröy, Christer B. Competition between hydrogen bonds and halogen bonds: a structural study New Journal of Chemistry, 2018, 42, 10539 |
| 7055306 | CIF | C10 H12 K N O5 S | C 1 2/c 1 | 37.539; 5.9129; 26.321 90; 121.1; 90 | 5002.6 | Pis Diez, Reinaldo; Echeverría, Gustavo A.; Piro, Oscar E.; Jios, Jorge Luis; Parajón Costa, Beatriz Susana Structural, Spectroscopic and Theoretical Study of an o-vanillin Schiff base derivative involved in enol-imine and keto-amine tautomerism New J. Chem., 2016 |
| 7058780 | CIF | C10 H12 N O7 V | F d d 2 | 22.236; 30.525; 7.549 90; 90; 90 | 5124 | Biswal, Debanjana; Pramanik, Nikhil Ranjan; Drew, Michael G. B.; Jangra, Nancy; Maurya, Mannar R.; Kundu, Mousumi; Sil, Parames C.; Chakrabarti, Syamal Synthesis, crystal structure, DFT calculations, protein interaction, anticancer potential and bromoperoxidase mimicking activity of oxidoalkoxidovanadium(v) complexes New Journal of Chemistry, 2019 |
| 7050546 | CIF | C10 H12 N2 O2 | P 1 21/n 1 | 3.897; 14.757; 16.305 90; 91.668; 90 | 937.3 | Eric A. Bruton; Lee Brammer; F. Christopher Pigge; Christer B. Aakeröy; Destin S. Leinen Hydrogen bond patterns in aromatic and aliphatic dioximes New J. Chem., 2003, 27, 1084-1094 |
| 7050549 | CIF | C10 H12 N2 O2 | P 1 21/c 1 | 8.1553; 14.208; 8.5134 90; 108.525; 90 | 935.3 | Eric A. Bruton; Lee Brammer; F. Christopher Pigge; Christer B. Aakeröy; Destin S. Leinen Hydrogen bond patterns in aromatic and aliphatic dioximes New J. Chem., 2003, 27, 1084-1094 |
| 7057668 | CIF | C10 H12 N2 O2 | P 1 n 1 | 6.5125; 5.9722; 12.1029 90; 95.656; 90 | 468.438 | Roy, Ankana; Das, Partha Jyoti; Diskin-Posner, Yael; Firer, Michael; Grynszpan, Flavio; Montag, Michael Quenching of syn-bimane fluorescence by Na+ complexation New Journal of Chemistry, 2018, 42, 15541 |
| 7061149 | CIF | C10 H12 N2 O2 | P 1 21/c 1 | 6.1321; 9.9927; 15.3343 90; 90.225; 90 | 939.621 | Kubota, Yasuhiro; Koide, Kenta; Mizuno, Yuka; Nakazawa, Masato; Inuzuka, Toshiyasu; Funabiki, Kazumasa; Sato, Hiroyasu; Matsui, Masaki Synthesis and fluorescence properties of unsymmetrical 1,4-dihydropyrrolo[3,2-b]pyrrole dyes New Journal of Chemistry, 2022, 46, 1533-1542 |
| 7052929 | CIF | C10 H12 N2 O3 | P -1 | 8.779; 24.3199; 30.6605 71.677; 84.871; 83.43 | 6163.5 | Lemmerer, Andreas; Fernandes, Manuel A. Adventures in co-crystal land: high Z′, stoichiometric variations, polymorphism and phase transitions in the co-crystals of four liquid and solid cyclic carboxylic acids with the supramolecular reagent isonicotinamide New Journal of Chemistry, 2012, 36, 2242 |
| 7057680 | CIF | C10 H12 N2 O4 | P -1 | 6.1091; 8.281; 11.0256 74.836; 87.904; 88.263 | 537.87 | Castells-Gil, Javier; Padial, Natalia M.; Martí-Gastaldo, Carlos Structural reorganization in a hydrogen-bonded organic framework New Journal of Chemistry, 2018, 42, 16138 |
| 7061555 | CIF | C10 H12 N2 O4 | P 1 21 1 | 10.9511; 7.5328; 12.7907 90; 99.332; 90 | 1041.17 | Wang, Yu; Xu, Yaoyao; Khan, Shahid; Zhang, Zhunjie; Khan, Ajmal Selective approach to N-substituted tertiary 2-pyridones New Journal of Chemistry, 2022, 46, 11138-11142 |
| 1551262 | CIF | C10 H12 N4 O6 S | P 1 21 1 | 5.3927; 31.353; 7.8011 90; 99.399; 90 | 1301.28 | de Moura Oliveira, Carlos H.; C. de Melo, Cristiane; Doriguetto, Antonio C. Sulfamethoxazole salts: crystal structures, conformations and solubility New Journal of Chemistry, 2019, 43, 10250 |
| 7058550 | CIF | C10 H13 Br Cu N4 S | P 1 21/n 1 | 13.7061; 14.2341; 14.124 90; 108.471; 90 | 2613.56 | Kaushal, Mani; Lobana, Tarlok S.; Nim, Lovedeep; Bala, Ritu; Arora, Daljit S.; Garcia-Santos, Isabel; Duff, Courtney E.; Jasinski, Jerry P. Synthesis of 2-acetylpyridine-N-substituted thiosemicarbazonates of copper(ii) with high antimicrobial activity against methicillin resistant S. aureus, K. pneumoniae 1 and C. albicans New Journal of Chemistry, 2019, 43, 11727 |
| 7052605 | CIF | C10 H13 Br4 N | P 1 21/c 1 | 13.284; 9.1181; 11.576 90; 97.245; 90 | 1390.9 | Li, Xian-Mei; Fan, Fan; Lu, Jing-Song; Xue, Sai-Feng; Zhang, Yun-Qian; Zhu, Qian-Jiang; Tao, Zhu; Lawrance, Geofferey A.; Wei, Gang Host‒guest complexes of cucurbit[8]uril with some pentaerythritol derivative guests New Journal of Chemistry, 2011, 35, 1088 |
| 7059102 | CIF | C10 H13 Cl2 F3 N2 O2 Pt S | P -1 | 7.1487; 8.918; 13.5059 82.385; 87.679; 66.909 | 785 | Bolotin, Dmitrii S.; Demakova, Marina Ya.; Legin, Anton A.; Suslonov, Vitaliy V.; Nazarov, Alexey A.; Jakupec, Michael A.; Keppler, Bernhard K.; Kukushkin, Vadim Yu. Amidoxime platinum(ii) complexes: pH-dependent highly selective generation and cytotoxic activity New Journal of Chemistry, 2017, 41, 6840 |
| 7058555 | CIF | C10 H13 Cu I N4 S | P 1 21/n 1 | 10.7; 8.889; 14.2638 90; 93.277; 90 | 1354.44 | Kaushal, Mani; Lobana, Tarlok S.; Nim, Lovedeep; Bala, Ritu; Arora, Daljit S.; Garcia-Santos, Isabel; Duff, Courtney E.; Jasinski, Jerry P. Synthesis of 2-acetylpyridine-N-substituted thiosemicarbazonates of copper(ii) with high antimicrobial activity against methicillin resistant S. aureus, K. pneumoniae 1 and C. albicans New Journal of Chemistry, 2019, 43, 11727 |
| 7050557 | CIF | C10 H13 Cu N3 O7 | P -1 | 7.0936; 9.8281; 10.1197 80.231; 81.306; 71.641 | 656.28 | José Carranza; Conor Brennan; Jorunn Sletten; Brita Vangdal; Paul Rillema; Francesc Lloret; Miguel Julve Syntheses, crystal structures and magnetic properties of new oxalato-, croconato- and squarato-containing copper(II) complexes New J. Chem., 2003, 27, 1775-1783 |
| 7052532 | CIF | C10 H13 N O2 | P 1 21/c 1 | 10.0724; 8.267; 11.7803 90; 111.75; 90 | 911.1 | Domínguez, Oscar; Rodríguez-Molina, Braulio; Rodríguez, Mario; Ariza, Armando; Farfán, Norberto; Santillan, Rosa X-Ray crystallographic and spectroscopic properties of eight Schiff bases as evidence of the proton transfer reaction. Role of the intermolecular hydrogen bond New Journal of Chemistry, 2011, 35, 156 |
| 7054620 | CIF | C10 H13 N4 O3 Zn | P 4/n c c :2 | 13.4761; 13.4761; 27.254 90; 90; 90 | 4949.5 | Zhu, Yu; Wang, Yan-Mei; Liu, Pan; Wu, Yun-Long; Wei, Wei; Xia, Chang-Kun; Xie, Ji-Min Cage-like pores of a metal‒organic framework for separations and encapsulation of Pd nanoparticles for efficient catalysis New J. Chem., 2015, 39, 2669 |
| 7056672 | CIF | C10 H13 N4 O6 P | P 1 n 1 | 4.4091; 8.6022; 17.525 90; 91.34; 90 | 664.5 | Wang, Jin-Wen; Li, Yao-Jia; Chen, Chen; Luo, Yang-Hui; Sun, Baiwang Substituent swap affect the crystal structure and properties of N-benzyl-4-amino-1, 2, 4-triazole related organic salts New J. Chem., 2017 |
| 7059716 | CIF | C10 H13 N5 O2 | P 1 21/n 1 | 18.9276; 4.6593; 24.5504 90; 99.376; 90 | 2136.2 | García-Raso, Angel; Terrón, Angel; Balle, Bartomeu; López-Zafra, Adela; Frontera, Antonio; Barceló-Oliver, Miquel; Fiol, Juan J. Crystal structures of N6-modified-amino acid nucleobase analogs(iii): adenine‒valeric acid, adenine‒hexanoic acid and adenine‒gabapentine New Journal of Chemistry, 2020, 44, 12236-12246 |
| 7059610 | CIF | C10 H14 Br2 Cu2 N4 S2 | P 1 21/c 1 | 9.5738; 10.568; 7.7642 90; 104.678; 90 | 759.91 | Beheshti, Azizolla; Mousavifard, Elham Sadat; Zargar, Behrooz; Mayer, Peter; Rezatofighi, Seyedeh Elham Synthesis and dye adsorption studies of the {dibromo(1,1′-(1,2-ethanediyl)bis(3-methyl-imidazole-2-thione)dicopper(i)}n polymer and its conversion to CuO nanospheres for photocatalytic and antibacterial applications New Journal of Chemistry, 2020, 44, 8520-8537 |
| 7059609 | CIF | C10 H14 Br3 Cu N4 S | P 1 21/c 1 | 12.885; 7.0118; 18.0443 90; 103.201; 90 | 1587.17 | Beheshti, Azizolla; Mousavifard, Elham Sadat; Zargar, Behrooz; Mayer, Peter; Rezatofighi, Seyedeh Elham Synthesis and dye adsorption studies of the {dibromo(1,1′-(1,2-ethanediyl)bis(3-methyl-imidazole-2-thione)dicopper(i)}n polymer and its conversion to CuO nanospheres for photocatalytic and antibacterial applications New Journal of Chemistry, 2020, 44, 8520-8537 |
| 7058144 | CIF | C10 H14 Br6 I2 N2 O2 Te | P -1 | 7.6363; 11.3319; 14.046 95.738; 93.775; 103.128 | 1172.83 | Shayapov, Vladimir R.; Usoltsev, Andrey N.; Adonin, Sergey A.; Sokolov, Maxim N.; Samsonenko, Denis G.; Fedin, Vladimir P. Thermochromism of bromotellurates(iv): experimental insights New Journal of Chemistry, 2019, 43, 3927 |
| 7060579 | CIF | C10 H14 Cl N O2 | C 1 2/c 1 | 15.8971; 6.3996; 21.4345 90; 90.022; 90 | 2180.64 | Kordestani, Nazanin; Amiri Rudbari, Hadi; Correia, Isabel; Valente, Andreia; Côrte-Real, Leonor; Islam, Mohammad Khairul; Micale, Nicola; Braun, Jason D.; Herbert, David E.; Tumanov, Nikolay; Wouters, Johan; Enamullah, Mohammed Heteroleptic enantiopure Pd(ii)-complexes derived from halogen-substituted Schiff bases and 2-picolylamine: synthesis, experimental and computational characterization and investigation of the influence of chirality and halogen atoms on the anticancer activity New Journal of Chemistry, 2021, 45, 9163-9180 |
| 7062469 | CIF | C10 H14 Cu N12 | P -1 | 8.1733; 9.3238; 15.0254 76.085; 77.688; 80.873 | 1078.89 | Mahmudov, Ibadulla; Gurbanov, Atash V.; Martins, Luísa M. D. R. S.; Abdullayev, Yusif; Sujayev, Afsun; Mahmudov, Kamran T.; Pombeiro, Armando J. L. Co(ii/iii), Ni(ii) and Cu(ii) complexes with a pyrazole-functionalized 1,3,5-triazopentadiene: synthesis, structure and application in the oxidation of styrene to benzaldehyde New Journal of Chemistry, 2023, 47, 10826-10833 |
| 7056925 | CIF | C10 H14 Cu N2 O7 S2 | P -1 | 7.2021; 9.469; 11.699 66.533; 80.57; 81.58 | 719 | Thakur, Neha; Pandey, Mrituanjay D.; Pandey, Rampal A uniquely fabricated Cu(ii)-metallacycle as a reusable highly sensitive dual-channel and practically functional metalloreceptor for Fe3+ and Ca2+ ions: an inorganic site of cation detection New Journal of Chemistry, 2018, 42, 3582 |
| 7062433 | CIF | C10 H14 Cu3 N4 O14 | P -1 | 5.1649; 6.8991; 12.568 96.615; 94.583; 102.134 | 432.41 | Klongdee, Fatima; Sasada, Yuto; Nakano, Motohiro; Chainok, Kittipong; Youngme, Sujittra; Boonmak, Jaursup Synthesis, X-ray structures, and magnetic properties of seven polynuclear Cu(ii) complexes containing pyrazole-3,5-dicarboxylate with various ancillary ligands New Journal of Chemistry, 2023, 47, 9669-9680 |
| 7059815 | CIF | C10 H14 Dy N O12 | P 1 21/c 1 | 14.53519; 11.48172; 8.90846 90; 99.0238; 90 | 1468.32 | Černák, Juraj; Harčárová, Katarína; Falvello, Larry R.; Dlháň, Ľubor; Titiš, Ján; Boča, Roman Field induced slow magnetic relaxation in a zig-zag chain-like Dy(iii) complex with the ligand o-phenylenedioxydiacetato New Journal of Chemistry, 2020, 44, 13458-13465 |
| 1558786 | CIF | C10 H14 F I N3 P | P 1 21/c 1 | 8.7566; 9.3257; 17.2049 90; 100.741; 90 | 1380.36 | Reichel, Marco; Unger, Cornelia; Dubovnik, Sviatlana; Roidl, Andreas; Kornath, Andreas; Karaghiosoff, Konstantin Synthesis, structural and toxicological investigations of quarternary phosphonium salts containing the P-bonded bioisosteric CH2F moiety New Journal of Chemistry, 2020, 44, 14306-14315 |
| 7062467 | CIF | C10 H14 N12 Ni | P 1 21/c 1 | 12.2955; 4.9045; 13.1699 90; 116.167; 90 | 712.79 | Mahmudov, Ibadulla; Gurbanov, Atash V.; Martins, Luísa M. D. R. S.; Abdullayev, Yusif; Sujayev, Afsun; Mahmudov, Kamran T.; Pombeiro, Armando J. L. Co(ii/iii), Ni(ii) and Cu(ii) complexes with a pyrazole-functionalized 1,3,5-triazopentadiene: synthesis, structure and application in the oxidation of styrene to benzaldehyde New Journal of Chemistry, 2023, 47, 10826-10833 |
| 7057506 | CIF | C10 H14 N2 O4 | P 21 21 21 | 5.2976; 13.2046; 15.2907 90; 90; 90 | 1069.63 | Seth, Saikat Kumar; Bauzá, Antonio; Frontera, Antonio Bipolar behaviour of salt-bridges: a combined theoretical and crystallographic study New Journal of Chemistry, 2018, 42, 12134 |
| 7057507 | CIF | C10 H14 N2 O4 | P 1 21/n 1 | 4.932; 20.575; 10.644 90; 97.413; 90 | 1071.1 | Seth, Saikat Kumar; Bauzá, Antonio; Frontera, Antonio Bipolar behaviour of salt-bridges: a combined theoretical and crystallographic study New Journal of Chemistry, 2018, 42, 12134 |
| 7051846 | CIF | C10 H14 N2 O6 | P 21 21 21 | 6.879; 10.3028; 15.9544 90; 90; 90 | 1130.74 | Delval, Franck; Spyratou, Alexandra; Verdan, Simon; Bernardinelli, Gerald; Williams, Alan F. The clash of the synthons: crystal structures of benzimidazole‒alcohol‒carboxylic acids New Journal of Chemistry, 2008, 32, 1394 |
| 7057957 | CIF | C10 H14 N3 O8 P | P -1 | 7.4008; 10.413; 10.972 109.76; 99.84; 104.2 | 741 | Li, Rui-Xia; Zhou, Lin; Shi, Ping-Ping; Zheng, Xuan; Gao, Ji-Xing; Ye, Qiong; Fu, Da-Wei High-temperature phase transitions, switchable dielectric behaviors and barocaloric effects in three new organic molecule-based crystals New Journal of Chemistry, 2019, 43, 154 |
| 7056351 | CIF | C10 H14 N4 | P b c a | 11.469; 9.506; 19.52 90; 90; 90 | 2128.2 | Łakomska, Iwona; babinska, magdalena; Wojtczak, Andrzej; Kozakiewicz, Anna; Sitkowski, Jerzy; Jarzecki, Andrzej A. Experimental and theoretical investigation of the complexation of 5-methyl-7-isobutyl-1,2,4-triazolo[1,5-a]pyrimidine by platinum(II) ion New J. Chem., 2017 |
| 7051702 | CIF | C10 H14 N4 O S | P 1 21/c 1 | 5.691; 18.042; 11.6058 90; 101.178; 90 | 1169 | Oms, Olivier; Norel, Lucie; Chamoreau, Lise-Marie; Rousselière, Hélène; Train, Cyrille Conformation and crystal packing sensitivity to substitution of thioxo- and oxo-tetrazane derivatives New Journal of Chemistry, 2009, 33, 1663 |
| 7051700 | CIF | C10 H14 N4 O2 | C 1 c 1 | 5.3123; 23.048; 9.1244 90; 103.276; 90 | 1087.3 | Oms, Olivier; Norel, Lucie; Chamoreau, Lise-Marie; Rousselière, Hélène; Train, Cyrille Conformation and crystal packing sensitivity to substitution of thioxo- and oxo-tetrazane derivatives New Journal of Chemistry, 2009, 33, 1663 |
| 7055884 | CIF | C10 H14 N7 O7 V | P 1 21/c 1 | 9.2182; 11.9215; 14.0719 90; 98.587; 90 | 1529.09 | Koleša-Dobravc, Tanja; Maejima, Keiichi; Yoshikawa, Yutaka; Meden, Anton; Yasui, Hiroyuki; Perdih, Franc Vanadium and zinc complexes of 5-cyanopicolinate and pyrazine derivatives: synthesis, structural elucidation and in vitro insulino-mimetic activity study New J. Chem., 2017, 41, 735 |
| 7057382 | CIF | C10 H14 O3 | P 1 21/c 1 | 9.9472; 6.1399; 16.775 90; 104.248; 90 | 993 | Gamekkanda, Janaka C.; Sinha, Abhijeet S.; Desper, John; Đaković, Marijana; Aakeröy, Christer B. Competition between hydrogen bonds and halogen bonds: a structural study New Journal of Chemistry, 2018, 42, 10539 |
| 7052171 | CIF | C10 H15 Ag Cl N6 O6 | P 1 21/n 1 | 10.3656; 14.7041; 11.0971 90; 111.493; 90 | 1573.77 | Fabrice Pointillart; Cyrille Train; Patrick Herson; Jérôme Marrot; Michel Verdaguer Verdazyl-based extended structures: synthesis, structures and magnetic properties of silver(i) one dimensional compounds New Journal of Chemistry, 2007, 31, 1001 |
| 7054951 | CIF | C10 H15 Ba N O9 P2 | P -1 | 5.4566; 8.6781; 16.081 92.8; 92.173; 105.253 | 732.76 | Luo, Hui; Ma, Chao; Jiao, Cheng-Qi; Sun, Zhen-Gang; Sun, Tong; Ma, Ming-Xue; Zhu, Yan-Yu; Li, Wen-Zhu; Wang, Mei-Ling; Zhang, Xiao-Wen Synthesis, structures, luminescent and molecular recognition properties of three new alkaline earth metal carboxyphosphonates with a 3D supramolecular structure New J. Chem., 2015, 39, 6611 |
| 7054949 | CIF | C10 H15 Ca N O9 P2 | P -1 | 6.9927; 8.0857; 14.201 101.016; 95.091; 101.324 | 766.12 | Luo, Hui; Ma, Chao; Jiao, Cheng-Qi; Sun, Zhen-Gang; Sun, Tong; Ma, Ming-Xue; Zhu, Yan-Yu; Li, Wen-Zhu; Wang, Mei-Ling; Zhang, Xiao-Wen Synthesis, structures, luminescent and molecular recognition properties of three new alkaline earth metal carboxyphosphonates with a 3D supramolecular structure New J. Chem., 2015, 39, 6611 |
| 7060722 | CIF | C10 H15 Cl2 Cu N5 O | P 1 21/c 1 | 6.8717; 23.169; 9.1083 90; 93.73; 90 | 1447.1 | Tupolova, Yulia P.; Levchenkov, Sergey I.; Popov, Leonid D.; Lebedev, Vladimir E.; Minin, Vadim V.; Efimov, Nikolay N.; Lazarenko, Vladimir A.; Zubavichus, Yan V.; Zubenko, Alexander A.; Shcherbakov, Igor N. Unprecedented interplay of antiferro- and ferromagnetic exchange interactions through intermolecular hydrogen bonds in mononuclear Cu(ii) complexes New Journal of Chemistry, 2021, 45, 12236-12246 |
| 7061581 | CIF | C10 H15 Cl2 N O3 Te | C 1 2 1 | 32.234; 5.615; 7.61 90; 100.28; 90 | 1355.3 | Tripathi, Abhishek; Deka, Rajesh; Butcher, Ray J.; Turner, David R.; Deacon, Glen B.; Singh, Harkesh B. Exploring the reactivity of L-tellurocystine, Te-protected tellurocysteine conjugates and diorganodiselenides towards hydrogen peroxide: synthesis and molecular structure analysis New Journal of Chemistry, 2022, 46, 10550-10559 |
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