Crystallography Open Database
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COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
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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 |
7054309 | CIF | C10 H15 Cu N O9 | P -1 | 7.558; 9.2626; 10.536 104.104; 90.218; 96.517 | 710.35 | Karmakar, Anirban; Hazra, Susanta; Guedes da Silva, M. Fátima C.; Pombeiro, Armando J. L. Synthesis, structure and catalytic applications of amidoterephthalate copper complexes in the diastereoselective Henry reaction in aqueous medium New J. Chem., 2014, 38, 4837 |
7053336 | CIF | C10 H15 N O3 | C 1 2/c 1 | 11.1325; 9.041; 21.0854 90; 100.098; 90 | 2089.3 | Clausen, Henrik F.; Chevallier, Marie S.; Spackman, Mark A.; Iversen, Bo B. Three new co-crystals of hydroquinone: crystal structures and Hirshfeld surface analysis of intermolecular interactions New Journal of Chemistry, 2010, 34, 193 |
7050967 | CIF | C10 H15 N3 O3 | P 1 21/c 1 | 7.394; 19.603; 8.107 90; 94.56; 90 | 1171.3 | Bertolasi, Valerio; Pretto, Loretta; Gilli, Paola; Ferretti, Valeria; Gilli, Gastone Hydrogen-bonded supramolecular structures in co-crystals of ??- or ??-diketone enols with 2,6-diaminopyridine or 2,4-diaminopyrimidine New Journal of Chemistry, 2002, 26, 1559 |
7054728 | CIF | C10 H15 N4 O5 P | P 1 21/c 1 | 12.2908; 7.0588; 17.6586 90; 109.425; 90 | 1444.82 | Gholivand, Khodayar; Molaei, Foroogh Synthesis and structural study of some new phosphorus(v) hydrazide compounds: spectroscopic evidence and a theoretical approach New J. Chem., 2015, 39, 3747 |
7054726 | CIF | C10 H15 N4 O6 P | P b c a | 8.8012; 13.0262; 25.0491 90; 90; 90 | 2871.8 | Gholivand, Khodayar; Molaei, Foroogh Synthesis and structural study of some new phosphorus(v) hydrazide compounds: spectroscopic evidence and a theoretical approach New J. Chem., 2015, 39, 3747 |
7053415 | CIF | C10 H15 O3 P | P 1 21/c 1 | 14.055; 4.6342; 16.179 90; 95.38; 90 | 1049.2 | Murugavel, Ramaswamy; Singh, Mayank Pratap One, two, and three methylene phosphonic acid groups (‒CH2PO3H2) on a mesitylene ring: synthesis, characterization and aspects of supramolecular aggregation New Journal of Chemistry, 2010, 34, 1846 |
7061178 | CIF | C10 H16 B2 Cu N16 | P b c a | 13.507; 8.2794; 16.968 90; 90; 90 | 1897.5 | Mei, Haozheng; Xu, Yiqiang; Lei, Guorong; Cao, Wenli; Li, Zhimin; Zhang, Jianguo Synthesis, structure and properties of a high-energy metal–organic framework fuel [Cu(MTZ)2(CTB)2]n New Journal of Chemistry, 2022, 46, 1687-1692 |
7055976 | CIF | C10 H16 Br2 Cl3 Fe N4 O | P b c n | 23.654; 8.738; 8.595 90; 90; 90 | 1776.5 | Govor, Evgen V.; Sanakis, Yiannis; Raptis, Raphael G. Synthesis of pyrazole (hemi)aminals via the cleavage of saturated aliphatic ether C‒O bonds in the presence of ferric halides New J. Chem., 2017, 41, 2220 |
7061954 | CIF | C10 H16 Cd Cl4 N2 S2 | F m m m | 7.459; 7.598; 31.724 90; 90; 90 | 1797.9 | Han, Li-Jun; Liu, Jia; Shao, Ting; Jia, Qiang-Qiang; Su, Chang-Yuan; Fu, Da-Wei; Lu, Hai-Feng A Cd-based perovskite with optical-electrical multifunctional response New Journal of Chemistry, 2022, 46, 17928-17933 |
7061955 | CIF | C10 H16 Cd Cl4 N2 S2 | P b c a | 7.5349; 7.3677; 31.746 90; 90; 90 | 1762.4 | Han, Li-Jun; Liu, Jia; Shao, Ting; Jia, Qiang-Qiang; Su, Chang-Yuan; Fu, Da-Wei; Lu, Hai-Feng A Cd-based perovskite with optical-electrical multifunctional response New Journal of Chemistry, 2022, 46, 17928-17933 |
7054698 | CIF | C10 H16 Cd N6 Ni O2 | C 1 2/c 1 | 10.8081; 10.4606; 14.2364 90; 107.209; 90 | 1537.5 | Şenocak, Ayşegül; Karadağ, Ahmet; Soylu, Mustafa Serkan; Andaç, Ömer Two novel cyanido-bridged polymeric complexes with suspension bridge type connections and a series of related complex salts: crystallographic and thermal characterizations New J. Chem., 2015, 39, 3675 |
7061621 | CIF | C10 H16 Cl2 N4 Pt | P n a 21 | 15.1567; 10.5298; 8.732 90; 90; 90 | 1393.6 | Rivera, Carolina; Bacilio-Beltrán, Héctor Alejandro; Puebla-Pérez, Ana Maria; Rangel-Salas, Irma Idalia; Alvarado–Rodríguez, José G; Flores-Moreno, Roberto; Velázquez- Juárez, Gilberto; Peregrina-Lucano, Alejandro Aarón; Becerra-Martinez, Elvia; Valdez-Ruvalcaba, Jaime; Rubio-Garcia, J. Emiliano; Cortes-Llamas, Sara Angelica Cis and trans platinum(II) N-heterocyclic carbene isomers: synthesis, characterization and biological activity New Journal of Chemistry, 2022 |
7061622 | CIF | C10 H16 Cl2 N4 Pt | P 1 21/c 1 | 6.584; 8.8961; 12.5131 90; 102.895; 90 | 714.43 | Rivera, Carolina; Bacilio-Beltrán, Héctor Alejandro; Puebla-Pérez, Ana Maria; Rangel-Salas, Irma Idalia; Alvarado–Rodríguez, José G; Flores-Moreno, Roberto; Velázquez- Juárez, Gilberto; Peregrina-Lucano, Alejandro Aarón; Becerra-Martinez, Elvia; Valdez-Ruvalcaba, Jaime; Rubio-Garcia, J. Emiliano; Cortes-Llamas, Sara Angelica Cis and trans platinum(II) N-heterocyclic carbene isomers: synthesis, characterization and biological activity New Journal of Chemistry, 2022 |
7055983 | CIF | C10 H16 Cl5 Fe N4 O | C 1 2/c 1 | 24.487; 8.7651; 8.5302 90; 110.281; 90 | 1717.3 | Govor, Evgen V.; Sanakis, Yiannis; Raptis, Raphael G. Synthesis of pyrazole (hemi)aminals via the cleavage of saturated aliphatic ether C‒O bonds in the presence of ferric halides New J. Chem., 2017, 41, 2220 |
7054022 | CIF | C10 H16 Cu N6 O5 | P b c n | 19.423; 8.6184; 16.8313 90; 90; 90 | 2817.48 | 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 |
7060810 | CIF | C10 H16 Cu2 Mo4 N4 O22 | P 1 21/n 1 | 11.1802; 13.4116; 15.9634 90; 90.678; 90 | 2393.45 | Zhang, Baoyue; Ying, Jun; Zhang, Xinyue; Wang, Chen; Tian, Aixiang Electrocatalytic, photocatalytic, fluorescence sensing and CO2RR properties of a series of homopolymolybdate hybrid coordination polymers New Journal of Chemistry, 2021, 45, 13340-13348 |
7055857 | CIF | C10 H16 Cu2 N4 O8 | C 1 2/c 1 | 12.4984; 7.2846; 17.4974 90; 102.95; 90 | 1552.5 | Cheng, Meiling; Sun, Lin; Han, Wei; Wang, Shen; Liu, Qi; Sun, Xiaoqiang; Xi, Haitao Effect of N ancillary ligands on the structure, nuclearity and magnetic behavior of Cu(ii)‒pyrazolecarboxylate complexes New J. Chem., 2016, 40, 10504 |
7057492 | CIF | C10 H16 N2 O5 S3 Sn2 | P 1 21/n 1 | 12.8556; 8.8721; 16.7333 90; 105.272; 90 | 1841.1 | Yan, Fei-Fei; Ma, Chun-Lin; Li, Qian-Li; Zhang, Shao-Liang; Ru, Jing; Cheng, Shuang; Zhang, Ru-Fen Syntheses, structures and anti-tumor activity of four organotin(iv) dicarboxylates based on (1,3,4-thiadiazole-2,5-diyldithio)diacetic acid New Journal of Chemistry, 2018, 42, 11601 |
7059271 | CIF | C10 H16 N5 O1.5 | P 1 2/n 1 | 10.0278; 10.815; 11.265 90; 98.834; 90 | 1207.2 | Lukov, Vladimir V.; Tsaturyan, Arshak A.; Tupolova, Yulia P.; Popov, Leonid D.; Shcherbakov, Igor N.; Lebedev, Vladimir E.; Askalepova, Olga I.; Lastovina, Tatiana A.; Lazarenko, Vladimir A.; Khustalev, Victor N.; Poler, Jordan C. Theoretical and experimental study of the coordination ability of 4,6-dimethylpyrimidinylhydrazone diacetylmonooxime towards Ni(ii), Mn(ii), Fe(iii) and Co(iii) ions New Journal of Chemistry, 2020, 44, 2146-2154 |
7054697 | CIF | C10 H16 N6 Ni O2 Zn | P b c n | 11.463; 8.9492; 14.7436 90; 90; 90 | 1512.5 | Şenocak, Ayşegül; Karadağ, Ahmet; Soylu, Mustafa Serkan; Andaç, Ömer Two novel cyanido-bridged polymeric complexes with suspension bridge type connections and a series of related complex salts: crystallographic and thermal characterizations New J. Chem., 2015, 39, 3675 |
7051697 | CIF | C10 H16 N6 S | P -1 | 7.6762; 8.512; 10.3122 104.177; 102.599; 93.444 | 632.94 | 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 |
7060721 | CIF | C10 H17 Br2 Cu N5 O2 | P 1 21/n 1 | 8.532; 15.288; 12.596 90; 107.57; 90 | 1566.3 | 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 |
7057036 | CIF | C10 H17 Br2 Cu2.5 N2 S2 | P -1 | 7.6203; 10.1947; 11.2268 79.856; 77.927; 83.881 | 837.34 | Himoto, K.; Suzuki, S.; Okubo, T.; Maekawa, M.; Kuroda-Sowa, T. A new semiconducting 1D Cu(i)‒Cu(ii) mixed-valence coordination polymer with Cu(ii) dimethylpiperidine‒dithiocarbamate and a tetranuclear Cu(i)‒Br cluster unit New Journal of Chemistry, 2018, 42, 3995 |
7056350 | CIF | C10 H17 Cl2 N5 Pt | P 1 21/c 1 | 13.983; 7.6739; 15.073 90; 116.36; 90 | 1449.2 | 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 |
7062791 | CIF | C10 H17 Cr O12 | P 1 21/c 1 | 8.3636; 12.1817; 14.06 90; 97.025; 90 | 1421.72 | Bazhina, Evgeniya S.; Shmelev, Maxim A.; Voronina, Julia K.; Korotkova, Natalia A.; Babeshkin, Konstantin A.; Matiukhina, Anna K.; Belova, Ekaterina V.; Gogoleva, Natalia V.; Kottsov, Sergey Yu.; Efimov, Nikolay N.; Kiskin, Mikhail A.; Eremenko, Igor L. Synthesis, structural features, magnetic properties and thermal decomposition of a new series of polymeric Ln(iii)–Cr(iii) cyclopropane-1,1-dicarboxylates New Journal of Chemistry, 2023, 47, 19251-19264 |
7054950 | CIF | C10 H17 N O10 P2 Sr | P -1 | 6.0359; 8.0803; 16.5511 93.878; 95.273; 102.285 | 782.25 | 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 |
7055313 | CIF | C10 H17 N3 O3 | P 1 21/c 1 | 7.0612; 17.0603; 10.3203 90; 97.42; 90 | 1232.84 | Wei, Tai-Bao; Zhu, Yuan-Rong; Li, Hui; Yan, Guo-Tao; Lin, Qi; Yao, Hong; Zhang, You-Ming A reversible fluorescent chemosensor for the rapid sensing of CN−in water: utilization of the intramolecular charge transfer blocking New J. Chem., 2016, 40, 2327 |
7051318 | CIF | C10 H18 Au2 N8 Ni | P 1 21/n 1 | 8.14; 16.191; 14.008 90; 105.9; 90 | 1775.5 | Chu, Ivan K.; Shek, Iris P. Y.; Michael Siu, K. W.; Wong, Wing-Tak; Zuo, Jing-Lin; Lau, Tai-Chu Synthesis, crystal structure and electrospray ionisation mass spectrometry of a novel one-dimensional cyano-bridged Ni(II)‒Au(I) polymer New Journal of Chemistry, 2000, 24, 765 |
7058656 | CIF | C10 H18 Br2 N4 Ni P2 | C 1 2/c 1 | 29.007; 8.7064; 14.4253 90; 107.572; 90 | 3473.1 | Kozáček, Pavel; Dostál, Libor; Růžička, Aleš; Císařová, Ivana; Černošek, Zdeněk; Erben, Milan Synthesis and coordination properties of new σ2,λ3-P/N switchable chelators based on [1,2,3]-diazaphosphole New Journal of Chemistry, 2019, 43, 13388 |
7053967 | CIF | C10 H18 Cl2 N2 | P 21 21 21 | 13.2941; 4.6884; 21.0334 90; 90; 90 | 1310.97 | Rojas-Sáenz, Héctor; Suárez-Moreno, Galdina V.; Ramos-García, Iris; Duarte-Hernández, Angélica M.; Mijangos, Edgar; Peña-Hueso, Adrián; Contreras, Rosalinda; Flores-Parra, Angelina 1,4-Dialkyl-1,4-diazabutadienes: their reactions with aluminum and indium halides New Journal of Chemistry, 2014, 38, 391 |
7059107 | CIF | C10 H18 Cl2 N2 O3 Pt S | P 1 21/c 1 | 7.7751; 15.9278; 13.8379 90; 103.11; 90 | 1669.02 | 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 |
7062979 | CIF | C10 H18 Cl4 N4 Pd | P 1 21/n 1 | 8.6646; 8.0989; 12.187 90; 103.52; 90 | 831.5 | Geng, Yanxue; Sun, Weijun; Zhang, Weixu; Li, Mengyao; Wang, Guo; Wang, Jianchun A new class of unique quinoidal-like imidazoliumyl tetrazinides: synthesis, structure, and mechanism New Journal of Chemistry, 2024, 48, 3467-3471 |
7058115 | CIF | C10 H18 Cl6 Fe2 N4 O | P -1 | 7.3221; 7.5071; 10.4916 102.996; 100.472; 92.433 | 550.47 | Scé, Fabio; Cano, Israel; Martin, Carmen; Beobide, Garikoitz; Castillo, Óscar; de Pedro, Imanol Comparing conventional and microwave-assisted heating in PET degradation mediated by imidazolium-based halometallate complexes New Journal of Chemistry, 2019, 43, 3476 |
7051117 | CIF | C10 H18 N2 | C 1 2/c 1 | 12.7395; 28.0431; 12.2071 90; 98.0824; 90 | 4317.7 | Trofimenko, Swiatoslaw; Rheingold, Arnold L.; Liable-Sands, Louise M.; María Claramunt, Rosa; López, Concepción; Dolores Santa María, María; Elguero, Jose The molecular structure of 4-tert-butylpyrazoles in the solid state and in solution: an X-ray, NMR and calorimetric study of the buttressing effect of a 4-tert-butyl substituent New Journal of Chemistry, 2001, 25, 819 |
7057014 | CIF | C10 H18 N2 O7 U | P 1 21/c 1 | 6.472; 27.71; 8.31 90; 110.61; 90 | 1394.9 | Sornosa-Ten, Alejandra; Jewula, Pawel; Fodor, Tamas; Brandès, Stéphane; Sladkov, Vladimir; Rousselin, Yoann; Stern, Christine; Chambron, Jean-Claude; Meyer, Michel Effects of preorganization in the chelation of UO22+by hydroxamate ligands: cyclic PIPO−vs.linear NMA− New Journal of Chemistry, 2018, 42, 7765 |
7055737 | CIF | C10 H19 Br3 N2 Pb | P 1 21/c 1 | 9.4696; 7.9769; 23.0327 90; 109.25; 90 | 1642.57 | Wan, Kun-Ming; Tong, Yuan-Bo; Li, Li; Zou, Yang; Duan, Hai-Bao; Liu, Jian-Lan; Ren, XiaoMing Investigation of thermochromic photoluminescent, dielectric and crystal structural properties for an inorganic-organic hybrid solid of [1-hexyl-3-methylimidazolium][PbBr3] New J. Chem., 2016 |
7055738 | CIF | C10 H19 Br3 N2 Pb | P 1 21/c 1 | 9.4917; 7.9842; 23.0848 90; 109.062; 90 | 1653.52 | Wan, Kun-Ming; Tong, Yuan-Bo; Li, Li; Zou, Yang; Duan, Hai-Bao; Liu, Jian-Lan; Ren, XiaoMing Investigation of thermochromic photoluminescent, dielectric and crystal structural properties for an inorganic-organic hybrid solid of [1-hexyl-3-methylimidazolium][PbBr3] New J. Chem., 2016 |
7055739 | CIF | C10 H19 Br3 N2 Pb | P 1 21/c 1 | 9.389; 7.955; 22.888 90; 109.638; 90 | 1610.1 | Wan, Kun-Ming; Tong, Yuan-Bo; Li, Li; Zou, Yang; Duan, Hai-Bao; Liu, Jian-Lan; Ren, XiaoMing Investigation of thermochromic photoluminescent, dielectric and crystal structural properties for an inorganic-organic hybrid solid of [1-hexyl-3-methylimidazolium][PbBr3] New J. Chem., 2016 |
7055740 | CIF | C10 H19 Br3 N2 Pb | P 1 21/c 1 | 9.4198; 7.9592; 22.961 90; 109.524; 90 | 1622.5 | Wan, Kun-Ming; Tong, Yuan-Bo; Li, Li; Zou, Yang; Duan, Hai-Bao; Liu, Jian-Lan; Ren, XiaoMing Investigation of thermochromic photoluminescent, dielectric and crystal structural properties for an inorganic-organic hybrid solid of [1-hexyl-3-methylimidazolium][PbBr3] New J. Chem., 2016 |
7055741 | CIF | C10 H19 Br3 N2 Pb | P 1 21/c 1 | 9.4442; 7.9704; 22.9992 90; 109.466; 90 | 1632.28 | Wan, Kun-Ming; Tong, Yuan-Bo; Li, Li; Zou, Yang; Duan, Hai-Bao; Liu, Jian-Lan; Ren, XiaoMing Investigation of thermochromic photoluminescent, dielectric and crystal structural properties for an inorganic-organic hybrid solid of [1-hexyl-3-methylimidazolium][PbBr3] New J. Chem., 2016 |
7055742 | CIF | C10 H19 Br3 N2 Pb | P 1 21/c 1 | 9.4561; 7.972; 23.0041 90; 109.354; 90 | 1636.14 | Wan, Kun-Ming; Tong, Yuan-Bo; Li, Li; Zou, Yang; Duan, Hai-Bao; Liu, Jian-Lan; Ren, XiaoMing Investigation of thermochromic photoluminescent, dielectric and crystal structural properties for an inorganic-organic hybrid solid of [1-hexyl-3-methylimidazolium][PbBr3] New J. Chem., 2016 |
7051453 | CIF | C10 H19 Cl F6 N P Ru S4 | C 1 m 1 | 12.264; 9.189; 8.822 90; 96.02; 90 | 989 | Santos, Teresa M.; Goodfellow, Brian J.; Madureira, João; Pedrosa de Jesus, Júlio; Félix, Vitor; Drew, Michael G. B. Synthesis and structural characterisation of new Ru^II^[12]aneS~4~ complexes with polypyridylic and related ligands New Journal of Chemistry, 1999, 23, 1015-1025 |
7059409 | CIF | C10 H19 Cl N2 | P 1 21 1 | 9.0742; 10.8811; 11.8127 90; 102.664; 90 | 1137.98 | Martin, Carmen; Cano, Israel; Scé, Fabio; Pérez-Aguirre, Rubén; Gimbert-Suriñach, Carolina; Lopez-Cornejo, Pilar; de Pedro, Imanol Synthesis of chiral iron-based ionic liquids: modelling stable hybrid materials New Journal of Chemistry, 2020, 44, 6375-6383 |
7062446 | CIF | C10 H19 N7 O5 S | P -1 | 6.849; 9.0017; 14.0341 92.744; 98.751; 112.305 | 785.89 | Karthick, Kettalu Ananthan; Shankar, Bhaskaran; Gayathri, Santhalingam; Aravind, Manikka Kubendran; Ashokkumar, Balasubramaniem; Tamilselvi, Arunachalam Dual responsive pyridoxal-AHMT based fluorescent sensor towards zinc(ii) and mercury(ii) ions and its bioimaging application New Journal of Chemistry, 2023, 47, 9427-9439 |
7050424 | CIF | C10 H2 F4 | P 1 21/a 1 | 5.7642; 11.4632; 6.112 90; 99.27; 90 | 398.58 | Khan, Muhammad S.; Al-Mandhary, Muna R. A.; Al-Suti, Mohammed K.; Corcoran, Timothy C.; Al-Mahrooqi, Yaqoub; Attfield, J. Paul; Feeder, Neil; David, William I. F.; Shankland, Kenneth; Friend, Richard H.; Köhler, Anna; Marseglia, Elisabeth A.; Tedesco, Emilio; Tang, Chiu C.; Raithby, Paul R.; Collings, Jonathan C.; Roscoe, Karl P.; Batsanov, Andrei S.; Stimson, Lorna M.; Marder, Todd B. Synthesis and optical characterisation of platinum(ii) poly-yne polymers incorporating substituted 1,4-diethynylbenzene derivatives and an investigation of the intermolecular interactions in the diethynylbenzene molecular precursorsElectronic supplementary information (ESI) available: atomic cooordinates for 6 and 7. See http://www.rsc.org/suppdata/nj/b2/b206946f/ New Journal of Chemistry, 2003, 27, 140 |
7059429 | CIF | C10 H2 N12 O10 | P 1 21/c 1 | 12.622; 5.8838; 11.1302 90; 107.75; 90 | 787.24 | Yan, Tingou; Cheng, Guangbin; Yang, Hongwei 1,3,4-Oxadiazole based thermostable energetic materials: synthesis and structure‒property relationship New Journal of Chemistry, 2020, 44, 6643-6651 |
7052298 | CIF | C10 H2 N8 | P 1 21/n 1 | 8.8515; 6.5515; 19.107 90; 96.48; 90 | 1100.9 | Emeric Lefebvre; Françoise Conan; Nathalie Cosquer; Jean-Michel Kerbaol; Mathieu Marchivie; Jean Sala-Pala; Marek M. Kubicki; Estelle Vigier; Carlos J. Gomez Garcia Syntheses, structural characterisation and magnetic properties of Fe(<small>II</small>) and Mn(<small>II</small>) compounds with the pentacyanopropenido ligand; structural characterisation of a substituted pyrazolo[1,5-<i>a</i>]pyrimidine New Journal of Chemistry, 2006, 30, 1197 |
7059373 | CIF | C10 H20 Cu N2 O10 S | P -1 | 7.782; 9.41; 11.461 87.598; 83.605; 77.477 | 814.1 | Sharma, Pranay; Gogoi, Anshuman; Verma, Akalesh K.; Frontera, Antonio; Bhattacharyya, Manjit K. Charge-assisted hydrogen bond and nitrile⋯nitrile interaction directed supramolecular associations in Cu(ii) and Mn(ii) coordination complexes: anticancer, hematotoxicity and theoretical studies New Journal of Chemistry, 2020, 44, 5473-5488 |
7050150 | CIF | C10 H20 O2 | P 1 21/c 1 | 22.844; 4.9612; 9.3977 90; 93.559; 90 | 1063.02 | Bond, Andrew D. On the crystal structures and melting point alternation of the n-alkyl carboxylic acidsElectronic supplementary information (ESI) available: crystallographic data for C6?C15 in tabular and .cif format, full details of temperature calibration and density measurement, packing coefficients and lattice binding energies, formal definitions of the orthogonal cells, details of all projections and measurements of all geometric parameters referred to in the text. See http://www.rsc.org/suppdata/nj/b3/b307208h/ New Journal of Chemistry, 2004, 28, 104 |
7055728 | CIF | C10 H20 O2 Se Si2 | P -4 | 11.0742; 11.0742; 6.4127 90; 90; 90 | 786.44 | Masuda, Toshiyuki; Inagaki, Yusuke; Momma, Hiroyuki; Kwon, Eunsang; Setaka, Wataru Facile synthesis of 2,5-bis(silyl)selenophene-1,1-dioxide and its photophysical properties New J. Chem., 2016, 40, 8593 |
7055729 | CIF | C10 H20 Se Si2 | P m m n :2 | 14.666; 14.776; 6.4741 90; 90; 90 | 1403 | Masuda, Toshiyuki; Inagaki, Yusuke; Momma, Hiroyuki; Kwon, Eunsang; Setaka, Wataru Facile synthesis of 2,5-bis(silyl)selenophene-1,1-dioxide and its photophysical properties New J. Chem., 2016, 40, 8593 |
7050556 | CIF | C10 H20.8 N3 Na O6.4 Ru | P 1 21 1 | 12.078; 19.01; 18.01 90; 97.77; 90 | 4097.2 | Pal, Pankaj K.; Drew, Michael G. B.; Truter, Mary R.; Tocher, Derek A.; Datta, Dipankar Light-assisted synthesis of a Ru(vi) nitrido complex by the reaction of azide with a Ru(iii) complex New Journal of Chemistry, 2003, 27, 786 |
7059682 | CIF | C10 H21 B10 N3 | P -1 | 13.4382; 14.3212; 19.229 71.551; 89.699; 75.284 | 3383.9 | Shmalko, Akim V.; Anufriev, Sergei A.; Stogniy, Marina Yu.; Suponitsky, Kyrill Yu.; Sivaev, Igor B. Synthesis and structure of 3-arylazo derivatives of ortho-carborane New Journal of Chemistry, 2020, 44, 10199-10202 |
7051360 | CIF | C10 H22 Br2 N4 O2 | P -1 | 5.2851; 8.0718; 9.5424 109.126; 104.189; 97.989 | 362.03 | Laurent Frémond; Enrique Espinosa; Michel Meyer; Franck Denat; Roger Guilard; Volker Huch; Michael Veith Synthesis, characterization and X-ray crystal structures of cyclam derivatives. Part IV. 1,4,8,11-Tetraazacyclotetradecane-5,12-dione and its diprotonated forms New J. Chem., 2000, 24, 959-966 |
7051451 | CIF | C10 H22 Cl F6 O P Ru S5 | P n m a | 9.21; 9.779; 22.6 90; 90; 90 | 2035 | Santos, Teresa M.; Goodfellow, Brian J.; Madureira, João; Pedrosa de Jesus, Júlio; Félix, Vitor; Drew, Michael G. B. Synthesis and structural characterisation of new Ru^II^[12]aneS~4~ complexes with polypyridylic and related ligands New Journal of Chemistry, 1999, 23, 1015-1025 |
7051361 | CIF | C10 H22 Cl2 N4 O10 | P 1 21/a 1 | 10.27; 16.169; 10.8995 90; 106.9; 90 | 1731.76 | Laurent Frémond; Enrique Espinosa; Michel Meyer; Franck Denat; Roger Guilard; Volker Huch; Michael Veith Synthesis, characterization and X-ray crystal structures of cyclam derivatives. Part IV. 1,4,8,11-Tetraazacyclotetradecane-5,12-dione and its diprotonated forms New J. Chem., 2000, 24, 959-966 |
7051962 | CIF | C10 H22 Cl4 Ga2 O4 | P 1 21/n 1 | 8.4505; 13.7024; 8.6396 90; 113.648; 90 | 916.4 | Basharat, Siama; Knapp, Caroline E.; Carmalt, Claire J.; Barnett, Sarah A.; Tocher, Derek A. Synthesis and structures of gallium alkoxides New Journal of Chemistry, 2008, 32, 1513 |
7058294 | CIF | C10 H22 Cu2 N2 O6 | P -1 | 4.6397; 8.8879; 10.1789 114.963; 97.981; 92.26 | 374.6 | Ahamad, M. Naqi; Shahid, M.; Ansari, Azaj; Kumar, Manjeet; Khan, Ishaat M.; Ahmad, Musheer; Rahisuddin, Rahisuddin; Arif, Rizwan A combined experimental and theoretical approach to investigate the structure, magnetic properties and DNA binding affinity of a homodinuclear Cu(ii) complex New Journal of Chemistry, 2019, 43, 7511 |
7055945 | CIF | C10 H22 N4 O6 Zn | P 1 21/c 1 | 14.998; 8.7997; 23.691 90; 148.87; 90 | 1616 | Bolotin, Dmitrii S.; Il'in, Mikhail V.; Novikov, Alexander S.; Bokach, Nadezhda A.; Suslonov, Vitalii V.; Kukushkin, Vadim Yu. Trinuclear (aminonitrone)ZnII complexes as key intermediates in zinc(ii)-mediated generation of 1,2,4-oxadiazoles from amidoximes and nitriles New J. Chem., 2017, 41, 1940 |
7061846 | CIF | C10 H23 B10 N O5 | P -1 | 7.4064; 11.1792; 12.0917 62.736; 85.701; 86.13 | 886.82 | Rys, Evgeny G.; Alpatova, Victoria M.; Kononova, Elena G.; Smol’yakov, Alexander F.; Moiseev, Sergey K.; Ol'shevskaya, Valentina A. Employment of Michael addition reactions for the functionalization of carboranes New Journal of Chemistry, 2022, 46, 18025-18032 |
7053170 | CIF | C10 H23 N O2 | P 1 21/c 1 | 5.4838; 26.117; 8.228 90; 100.331; 90 | 1159.3 | McCrary, Parker D.; Beasley, Preston A.; Gurau, Gabriela; Narita, Asako; Barber, Patrick S.; Cojocaru, O. Andreea; Rogers, Robin D. Drug specific, tuning of an ionic liquid's hydrophilic‒lipophilic balance to improve water solubility of poorly soluble active pharmaceutical ingredients New Journal of Chemistry, 2013, 37, 2196 |
7051961 | CIF | C10 H24 Cl Ga N2 O2 | P -1 | 7.7913; 7.9556; 12.052 99.069; 93.211; 102.462 | 717.2 | Basharat, Siama; Knapp, Caroline E.; Carmalt, Claire J.; Barnett, Sarah A.; Tocher, Derek A. Synthesis and structures of gallium alkoxides New Journal of Chemistry, 2008, 32, 1513 |
7051389 | CIF | C10 H24 Cl2 N4 Ti | P 21 21 21 | 7.053; 13.818; 16.452 90; 90; 90 | 1603.4 | New Journal of Chemistry, 1999 |
7051359 | CIF | C10 H24 N4 O4 | P -1 | 7.559; 4.997; 10.293 116.96; 91.55; 100.31 | 338.3 | Laurent Frémond; Enrique Espinosa; Michel Meyer; Franck Denat; Roger Guilard; Volker Huch; Michael Veith Synthesis, characterization and X-ray crystal structures of cyclam derivatives. Part IV. 1,4,8,11-Tetraazacyclotetradecane-5,12-dione and its diprotonated forms New J. Chem., 2000, 24, 959-966 |
7055722 | CIF | C10 H25 Cl6 N4 O2 W | P 1 21/c 1 | 8.8051; 13.364; 9.6474 90; 107.1; 90 | 1085 | Bortoluzzi, Marco; Marchetti, Fabio; Pampaloni, Guido; Zacchini, Stefano The chemistry of high valent tungsten chlorides with N-substituted ureas, including urea self-protonation reactions triggered by WCl6 New J. Chem., 2016, 40, 8271 |
7061917 | CIF | C10 H26 Br6 Cl2 N2 Pb2 | P n a 21 | 7.93; 17.238; 9.7334 90; 90; 90 | 1330.5 | Li, Duo-Fu; Zhao, Peng-Ju; Deng, Xiang-Hong; Wu, Yao-Zhen; He, Xiao-Li; Liu, Dong-Sheng; Li, Yong-Xiu; Sui, Yan A new organic–inorganic hybrid perovskite ferroelectric [ClCH2CH2N(CH3)3][PbBr3] and Its PVDF matrix-assisted highly-oriented flexible ferroelectric films New Journal of Chemistry, 2022, 46, 19391-19400 |
7061931 | CIF | C10 H26 Cl4 F2 Mn N2 | P 1 21/c 1 | 9.3174; 15.306; 13.558 90; 95.311; 90 | 1925.2 | You, Xiuli; Wang, Lingyu; Peng, Ziqin; Wei, Zhenhong Two manganese chloride organic–inorganic hybrid compounds showing strong luminescence and switchable phase transition and dielectric anomaly New Journal of Chemistry, 2022, 46, 20005-20009 |
7060498 | CIF | C10 H26 F8 N10 O10 Ru2 Si | P -1 | 6.7669; 9.2867; 11.445 103.78; 101.152; 103.764 | 654.19 | Mikhailov, Artem A.; Komarov, Vladislav Yu.; Pishchur, Denis P.; Schaniel, Dominik; Kostin, Gennadiy A. Nitrosyl linkage photoisomerization in heteroleptic fluoride ruthenium complexes derived from labile nitrate precursors New Journal of Chemistry, 2021, 45, 8192-8202 |
7052663 | CIF | C10 H26 N4 O4 | P 1 21/c 1 | 10.609; 5.2; 14.302 90; 112.627; 90 | 728.27 | Martí-Rujas, Javier; Kariuki, Benson M.; Hughes, Colan E.; Morte-Ródenas, Anabel; Guo, Fang; Glavcheva-Laleva, Zornitza; Taştemür, Kemal; Ooi, Li-ling; Yeo, Lily; Harris, Kenneth D. M. Structural diversity, but no polymorphism, in a homologous family of co-crystals of urea and α,ω-dihydroxyalkanes New Journal of Chemistry, 2011, 35, 1515 |
7051229 | CIF | C10 H27 Au Cl4 O8 | P 1 21/n 1 | 7.9346; 18.6728; 13.9672 90; 104.485; 90 | 2003.62 | Maria Calleja; Sax A. Mason; Paul D. Prince; Jonathan W. Steed; Clive Wilkinson Single Crystal Neutron and X-ray Diffraction Studies of (H7O3)[AuCl4]·15-crown-5. New Journal of Chemistry, 2001 |
7051230 | CIF | C10 H27 Au Cl4 O8 | P 1 21/n 1 | 7.9441; 18.6964; 13.9886 90; 104.347; 90 | 2012.9 | Maria Calleja; Sax A. Mason; Paul D. Prince; Jonathan W. Steed; Clive Wilkinson Single Crystal Neutron and X-ray Diffraction Studies of (H7O3)[AuCl4]·15-crown-5. New Journal of Chemistry, 2001 |
7052475 | CIF | C10 H27 Au Cl4 O8 | P 1 21/n 1 | 7.9346; 18.6728; 13.9672 90; 104.485; 90 | 2003.62 | Calleja, Maria; Mason, Sax A.; Paul D. Prince; Steed, Jonathan W.; Wilkinson, Clive Single crystal neutron and X-ray diffraction studies of (H7O3)[AuCl4]·15-crown-5 New Journal of Chemistry, 2001, 25, 1475-1478 |
7052476 | CIF | C10 H27 Au Cl4 O8 | P 1 21/n 1 | 7.9441; 18.6964; 13.9886 90; 104.347; 90 | 2012.9 | Calleja, Maria; Mason, Sax A.; Paul D. Prince; Steed, Jonathan W.; Wilkinson, Clive Single crystal neutron and X-ray diffraction studies of (H7O3)[AuCl4]·15-crown-5 New Journal of Chemistry, 2001, 25, 1475-1478 |
7050436 | CIF | C10 H27 Mo12 N5 O45 P | P 1 21/c 1 | 10.182; 21.356; 21.703 90; 100.55; 90 | 4639.5 | Vitoria, Pablo; Ugalde, María; Gutiérrez-Zorrilla, Juan M.; Román, Pascual; Luque, Antonio; San Felices, Leire; García-Tojal, Javier Organic‒inorganic hybrids based on four-electron reduced Keggin β-isomer phosphododecamolybdates and diazines New Journal of Chemistry, 2003, 27, 399 |
7050963 | CIF | C10 H28 Cl N7 Ni O4 | P 1 21/c 1 | 8.3715; 18.4; 12.2042 90; 95.958; 90 | 1869.7 | Montserrat Monfort; Inmaculada Resino; Joan Ribas; Xavier Solans; Mercé Font-Bardia; Helen Stoeckli-Evans Four new NiII antiferromagnetic complexes with azido bridges New J. Chem., 2002, 26, 1601-1606 |
7051207 | CIF | C10 H28 F6 N5 Ni O2 P | P c a 21 | 12.698; 10.1097; 15.698 90; 90; 90 | 2015.2 | Montserrat Monfort; Inmaculada Resino; Joan Ribas; Xavier Solans; Mercé Font-Bardia Synthesis of N3−/SCN− bridged polynuclear complexes of nickel(II) using N,N,N'-trimethylethane-1,2-diamine as a blocking ligand: low temperature magnetic study and single crystal structure of [Ni(μ1,1-N3)(μ1,3-N3)(N,N,N'-Me3en)]n New J. Chem., 2001, 25, 1577-1582 |
7056740 | CIF | C10 H28 Ga2 N2 O2 | P 1 21/n 1 | 6.6946; 10.7516; 11.4183 90; 95.446; 90 | 818.15 | Cybularczyk, Martyna; Zaremba, Rafał; Hurko, Aleksander; Plichta, Andrzej Tadeusz; Dranka, Maciej; Horeglad, Paweł Dialkylgallium alkoxides ‒ a tool for facile and stereoselective synthesis of PLA-drug conjugates New Journal of Chemistry, 2017 |
7057988 | CIF | C10 H29 Cl2 Cu N25 O10 | P -1 | 10.6159; 10.7796; 13.8295 89.498; 80.568; 83.99 | 1552.55 | Zeisel, Lukas; Szimhardt, Norbert; Wurzenberger, Maximilian H. H.; Klapötke, Thomas M.; Stierstorfer, Jörg 2-Methyl-substituted monotetrazoles in copper(ii) perchlorate complexes: manipulating coordination chemistry and derived energetic properties New Journal of Chemistry, 2019, 43, 609 |
7050260 | CIF | C10 H30 Cl2 Cu2 N12 O8 | P -1 | 8.524; 8.78; 11.32 71.79; 68.88; 63.2 | 693.9 | Albert Escuer; Mercè Font-Bardía; Salah S. Massoud; Franz A. Mautner; Evaristo Peñalba; Xavier Solans; Ramon Vicente Three new dinuclear copper(II) complexes with [Cu(μ1,3-N3)2Cu]2+ and [Cu(μ1,1-N3)2Cu]2+ asymmetrical cores: syntheses, structures and magnetic behaviour New J. Chem., 2004, 28, 681-686 |
7060063 | CIF | C10 H34 N20 O21 Sr2 | P b c a | 17.068; 17.764; 21.772 90; 90; 90 | 6601 | Wang, Yanna; Yang, Xiaoming; Hu, Jie; Li, Haibo; Li, Zhimin; Zhang, Tonglai Insensitive energetic compounds: alkaline earth metal salts of 5,5′-dinitramino-3,3′-methylene-1H-1,2,4-bistriazolate New Journal of Chemistry, 2020, 44, 19054-19060 |
7051484 | CIF | C10 H36 Cl2 Nd2 O20 | P 1 | 7.877; 8.781; 10.444 110.69; 95.24; 103.48 | 645.1 | New Journal of Chemistry, 1999 |
7063059 | CIF | C10 H4 Br2 N2 | P -1 | 3.8871; 16.768; 16.927 104.837; 90.598; 93.363 | 1064.3 | Ali, Hasrat; van Lier, Johan E. gem-Dibromovinyl phthalonitriles: synthesis, structure elucidation, Hirshfeld surface analysis and energy framework calculations New Journal of Chemistry, 2024, 48, 6350-6366 |
7050423 | CIF | C10 H4 F2 | P 1 21/c 1 | 3.8535; 5.906; 16.221 90; 95.23; 90 | 367.63 | Khan, Muhammad S.; Al-Mandhary, Muna R. A.; Al-Suti, Mohammed K.; Corcoran, Timothy C.; Al-Mahrooqi, Yaqoub; Attfield, J. Paul; Feeder, Neil; David, William I. F.; Shankland, Kenneth; Friend, Richard H.; Köhler, Anna; Marseglia, Elisabeth A.; Tedesco, Emilio; Tang, Chiu C.; Raithby, Paul R.; Collings, Jonathan C.; Roscoe, Karl P.; Batsanov, Andrei S.; Stimson, Lorna M.; Marder, Todd B. Synthesis and optical characterisation of platinum(ii) poly-yne polymers incorporating substituted 1,4-diethynylbenzene derivatives and an investigation of the intermolecular interactions in the diethynylbenzene molecular precursorsElectronic supplementary information (ESI) available: atomic cooordinates for 6 and 7. See http://www.rsc.org/suppdata/nj/b2/b206946f/ New Journal of Chemistry, 2003, 27, 140 |
7057362 | CIF | C10 H4 F4 I2 N2 | P 1 21/c 1 | 4.3271; 24.896; 11.8038 90; 97.033; 90 | 1262.03 | 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 |
7057363 | CIF | C10 H4 F4 I2 N2 | P -1 | 5.7902; 8.7132; 13.4792 72.603; 79.867; 85.571 | 638.59 | 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 |
7060064 | CIF | C10 H44 Ca2 N20 O26 | P 1 21/n 1 | 20.691; 8.2319; 21.708 90; 91.83; 90 | 3695.6 | Wang, Yanna; Yang, Xiaoming; Hu, Jie; Li, Haibo; Li, Zhimin; Zhang, Tonglai Insensitive energetic compounds: alkaline earth metal salts of 5,5′-dinitramino-3,3′-methylene-1H-1,2,4-bistriazolate New Journal of Chemistry, 2020, 44, 19054-19060 |
7059473 | CIF | C10 H5 Br N2 S Te | P b c n | 11.9421; 7.2245; 24.8025 90; 90; 90 | 2139.85 | Romito, Deborah; Biot, Nicolas; Babudri, Francesco; Bonifazi, Davide Non-covalent bridging of bithiophenes through chalcogen bonding grips New Journal of Chemistry, 2020, 44, 6732-6738 |
7058098 | CIF | C10 H5 Br2 N4 O3 Re | P -1 | 6.769; 8.079; 13.343 106.008; 102.69; 91.343 | 681.5 | Pizarro, Nancy; Saldías, Marianela; Guzmán, Nicolás; Sandoval-Altamirano, Catalina; Kahlal, Samia; Saillard, Jean-Yves; Hamon, Jean-René; Vega, Andrés 1IL and 3MLCT excited states modulated by H+: the structure and photophysical properties of [(2-bromo-5-(1H-pyrazol-1-yl)pyrazine)Re(CO)3Br] New Journal of Chemistry, 2019, 43, 2449 |
7058099 | CIF | C10 H5 Br2 N4 O3 Re | P -1 | 6.612; 7.947; 13.079 105.928; 102.163; 92.124 | 642.7 | Pizarro, Nancy; Saldías, Marianela; Guzmán, Nicolás; Sandoval-Altamirano, Catalina; Kahlal, Samia; Saillard, Jean-Yves; Hamon, Jean-René; Vega, Andrés 1IL and 3MLCT excited states modulated by H+: the structure and photophysical properties of [(2-bromo-5-(1H-pyrazol-1-yl)pyrazine)Re(CO)3Br] New Journal of Chemistry, 2019, 43, 2449 |
7059941 | CIF | C10 H5 Cl F3 N3 O2 | P -1 | 6.6403; 8.1037; 11.1004 106.45; 101.623; 93.168 | 557.1 | Espitia Cogollo, E.; Piro, O. E.; Echeverría, G. A.; Tuttolomondo, M. E.; Pérez, H.; Jios, J. L.; Ulic, S. E. Hydrogen bonding interactions in fluorinated 1,2,3-triazole derivatives New Journal of Chemistry, 2020, 44, 16006-16019 |
7050422 | CIF | C10 H5 F | P 1 21/c 1 | 3.878; 5.947; 15.8 90; 93.46; 90 | 363.72 | Khan, Muhammad S.; Al-Mandhary, Muna R. A.; Al-Suti, Mohammed K.; Corcoran, Timothy C.; Al-Mahrooqi, Yaqoub; Attfield, J. Paul; Feeder, Neil; David, William I. F.; Shankland, Kenneth; Friend, Richard H.; Köhler, Anna; Marseglia, Elisabeth A.; Tedesco, Emilio; Tang, Chiu C.; Raithby, Paul R.; Collings, Jonathan C.; Roscoe, Karl P.; Batsanov, Andrei S.; Stimson, Lorna M.; Marder, Todd B. Synthesis and optical characterisation of platinum(ii) poly-yne polymers incorporating substituted 1,4-diethynylbenzene derivatives and an investigation of the intermolecular interactions in the diethynylbenzene molecular precursorsElectronic supplementary information (ESI) available: atomic cooordinates for 6 and 7. See http://www.rsc.org/suppdata/nj/b2/b206946f/ New Journal of Chemistry, 2003, 27, 140 |
7059942 | CIF | C10 H5 F3 N4 O4 | P 1 21/n 1 | 5.0192; 17.4035; 13.0726 90; 94.057; 90 | 1139.05 | Espitia Cogollo, E.; Piro, O. E.; Echeverría, G. A.; Tuttolomondo, M. E.; Pérez, H.; Jios, J. L.; Ulic, S. E. Hydrogen bonding interactions in fluorinated 1,2,3-triazole derivatives New Journal of Chemistry, 2020, 44, 16006-16019 |
7052688 | CIF | C10 H5 I O3 | P 21 21 21 | 4.9287; 13.501; 14.126 90; 90; 90 | 940 | 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 |
7052689 | CIF | C10 H5 I O3 | C 1 c 1 | 15.725; 14.103; 14.188 90; 115.484; 90 | 2840 | 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 |
7052690 | CIF | C10 H5 I O3 | C 1 c 1 | 37.766; 4.9473; 15.836 90; 106.025; 90 | 2843.8 | 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 |
7052570 | CIF | C10 H6 Ag F3 N4 O4 S | P 1 2/c 1 | 12.8437; 8.3562; 25.59 90; 90.944; 90 | 2746.1 | Wan, Chong-Qing; Mak, Thomas C. W. Supramolecular frameworks constructed from angular-shaped sulfonyldipyrazine and various silver(i) salts New Journal of Chemistry, 2011, 35, 319 |
7062032 | CIF | C10 H6 B F4 S2 | P m n 21 | 10.1169; 6.6072; 46.904 90; 90; 90 | 3135.3 | Roemmele, Tracey L.; Knight, Fergus R.; Crawford, Ellis; Robertson, Stuart D.; Bode, Bela E.; Bühl, Michael; Slawin, Alexandra M. Z.; Woollins, J. Derek; Boeré, René T. Chalcogen controlled redox behaviour in peri-substituted S, Se and Te naphthalene derivatives New Journal of Chemistry, 2022, 46, 22363-22383 |
7060197 | CIF | C10 H6 B2 F6 N6 Na2 O3 | C 1 2/c 1 | 15.4584; 7.7624; 15.2266 90; 99.787; 90 | 1800.51 | Schopper, Nils; Sprenger, Jan A. P.; Zapf, Ludwig; Reiss, Guido J.; Ignat’ev, Nikolai V.; Finze, Maik Alkoxycyanoborates: metal salts and low-viscosity ionic liquids New Journal of Chemistry, 2021, 45, 14973-14987 |
7054125 | CIF | C10 H6 Br N O3.63 | P n a 21 | 21.092; 20.588; 4.6388 90; 90; 90 | 2014.4 | 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 |
7057225 | CIF | C10 H6 Br2 Cl4 Cu N2 | C 1 2/m 1 | 15.5239; 14.3008; 7.9558 90; 118.373; 90 | 1554 | Awwadi, Firas F.; Turnbull, Mark M.; Alwahsh, Manal I.; Haddad, Salim F. May halogen bonding interactions compete with Cu⋯Cl semi-coordinate bonds? Structural, magnetic and theoretical studies of two polymorphs of trans-bis(5-bromo-2-chloro pyridine)dichlorocopper(ii) and trans-bis(2,5-dichloropyridine)dichlorocopper(ii) New Journal of Chemistry, 2018, 42, 10642 |
7057227 | CIF | C10 H6 Br2 Cl4 Cu N2 | C 1 2/c 1 | 8.252; 12.8053; 14.6136 90; 90.902; 90 | 1544.02 | Awwadi, Firas F.; Turnbull, Mark M.; Alwahsh, Manal I.; Haddad, Salim F. May halogen bonding interactions compete with Cu⋯Cl semi-coordinate bonds? Structural, magnetic and theoretical studies of two polymorphs of trans-bis(5-bromo-2-chloro pyridine)dichlorocopper(ii) and trans-bis(2,5-dichloropyridine)dichlorocopper(ii) New Journal of Chemistry, 2018, 42, 10642 |
7061847 | CIF | C10 H6 Br2 Cu I4 N2 | P 1 21/n 1 | 6.6555; 8.5691; 16.085 90; 98.12; 90 | 908.2 | Alwahsh, Manal I.; Awwadi, Firas F.; Kailani, Mohammed H. Polymorphism and isomorphism in trans-bis(2,5-diiodopyridine)dihalocopper(ii) complexes: theoretical and crystallographic studies New Journal of Chemistry, 2022, 46, 19024-19035 |
7061849 | CIF | C10 H6 Br2 Cu I4 N2 | P -1 | 6.6977; 8.5845; 8.6691 71.645; 74.675; 89.946 | 454.41 | Alwahsh, Manal I.; Awwadi, Firas F.; Kailani, Mohammed H. Polymorphism and isomorphism in trans-bis(2,5-diiodopyridine)dihalocopper(ii) complexes: theoretical and crystallographic studies New Journal of Chemistry, 2022, 46, 19024-19035 |
7052189 | CIF | C10 H6 Br2 N2 S2 | P 1 21/c 1 | 4.5456; 26.9807; 10.0137 90; 97.484; 90 | 1217.65 | Ghazzali, Mohamed; Langer, Vratislav; Lopes, Cesar; Eriksson, Anders; Öhrström, Lars Syntheses, crystal structures, optical limiting properties, and DFT calculations of three thiophene-2-aldazine Schiff base derivatives New Journal of Chemistry, 2007, 31, 1777 |
7052190 | CIF | C10 H6 Br2 N2 S2 | P 1 21/c 1 | 10.6766; 11.5253; 10.2713 90; 96.797; 90 | 1255.01 | Ghazzali, Mohamed; Langer, Vratislav; Lopes, Cesar; Eriksson, Anders; Öhrström, Lars Syntheses, crystal structures, optical limiting properties, and DFT calculations of three thiophene-2-aldazine Schiff base derivatives New Journal of Chemistry, 2007, 31, 1777 |
7061848 | CIF | C10 H6 Cl2 Cu I4 N2 | C 1 2/c 1 | 8.7666; 13.2248; 14.7942 90; 91.012; 90 | 1714.92 | Alwahsh, Manal I.; Awwadi, Firas F.; Kailani, Mohammed H. Polymorphism and isomorphism in trans-bis(2,5-diiodopyridine)dihalocopper(ii) complexes: theoretical and crystallographic studies New Journal of Chemistry, 2022, 46, 19024-19035 |
7061850 | CIF | C10 H6 Cl2 Cu I4 N2 | P -1 | 6.679; 8.508; 8.869 70.54; 72.42; 88.46 | 451.5 | Alwahsh, Manal I.; Awwadi, Firas F.; Kailani, Mohammed H. Polymorphism and isomorphism in trans-bis(2,5-diiodopyridine)dihalocopper(ii) complexes: theoretical and crystallographic studies New Journal of Chemistry, 2022, 46, 19024-19035 |
7057226 | CIF | C10 H6 Cl6 Cu N2 | C 1 2/c 1 | 8.1852; 12.5785; 14.585 90; 91.223; 90 | 1501.29 | Awwadi, Firas F.; Turnbull, Mark M.; Alwahsh, Manal I.; Haddad, Salim F. May halogen bonding interactions compete with Cu⋯Cl semi-coordinate bonds? Structural, magnetic and theoretical studies of two polymorphs of trans-bis(5-bromo-2-chloro pyridine)dichlorocopper(ii) and trans-bis(2,5-dichloropyridine)dichlorocopper(ii) New Journal of Chemistry, 2018, 42, 10642 |
7057228 | CIF | C10 H6 Cl6 Cu N2 | C 1 2/c 1 | 16.4247; 14.1799; 14.5688 90; 120.219; 90 | 2932 | Awwadi, Firas F.; Turnbull, Mark M.; Alwahsh, Manal I.; Haddad, Salim F. May halogen bonding interactions compete with Cu⋯Cl semi-coordinate bonds? Structural, magnetic and theoretical studies of two polymorphs of trans-bis(5-bromo-2-chloro pyridine)dichlorocopper(ii) and trans-bis(2,5-dichloropyridine)dichlorocopper(ii) New Journal of Chemistry, 2018, 42, 10642 |
7051438 | CIF | C10 H6 Cr O5 | P -1 | 7.0349; 7.2332; 11.1518 88.71; 81.733; 63.012 | 499.82 | pi-Bonded organometallic building blocks for supramolecular chemistry. New Journal of Chemistry, 1999 |
7055683 | CIF | C10 H6 Cu N6 O8 | P -1 | 7.9317; 8.7062; 11.2388 100.563; 107.502; 104.506 | 687.88 | Yang, Qi; Ge, Jing; Gong, Qibing; Song, Xiaxia; Zhao, Jinwen; Wei, Qing; Xie, Gang; Chen, Sanping; Gao, Shengli Two energetic complexes incorporating 3,5-dinitrobenzoic acid and azole ligands: microwave-assisted synthesis, favorable detonation properties, insensitivity and effects on the thermal decomposition of RDX New J. Chem., 2016, 40, 7779 |
7059939 | CIF | C10 H6 F3 N3 O2 | P 1 21/n 1 | 6.6999; 20.5919; 7.634 90; 107.377; 90 | 1005.15 | Espitia Cogollo, E.; Piro, O. E.; Echeverría, G. A.; Tuttolomondo, M. E.; Pérez, H.; Jios, J. L.; Ulic, S. E. Hydrogen bonding interactions in fluorinated 1,2,3-triazole derivatives New Journal of Chemistry, 2020, 44, 16006-16019 |
7059433 | CIF | C10 H6 N12 O12 | P 1 21/c 1 | 9.3522; 11.3926; 17.9538 90; 98.457; 90 | 1892.1 | Yan, Tingou; Cheng, Guangbin; Yang, Hongwei 1,3,4-Oxadiazole based thermostable energetic materials: synthesis and structure‒property relationship New Journal of Chemistry, 2020, 44, 6643-6651 |
7054157 | CIF | C10 H6 N2 O4 | P 1 21/c 1 | 7.097; 19.995; 7.478 90; 112.227; 90 | 982.3 | Loots, Leigh; Haynes, Delia A.; Roex, Tanya le Synthesis and solid-state supramolecular chemistry of a series of pyridinium-derived zwitterions New Journal of Chemistry, 2014, 38, 2778 |
1544071 | CIF | C10 H7 Ag2 Fe N7 | C 1 m 1 | 6.734; 12.536; 9.12 90; 118.622; 90 | 675.8 | Gural'skiy, Il'ya A.; Shylin, Sergii I.; Golub, Bohdan O.; Ksenofontov, Vadim; Fritsky, Igor O.; Tremel, Wolfgang High temperature spin crossover in [Fe(pyrazine){Ag(CN)2}2] and its solvate New J. Chem., 2016, 40, 9012 |
7051967 | CIF | C10 H7 Br O2 S2 | P 21 21 21 | 4.1115; 14.688; 17.247 90; 90; 90 | 1041.54 | Hergué, Noémie; Leriche, Philippe; Blanchard, Philippe; Allain, Magali; Gallego-Planas, Nuria; Frère, Pierre; Roncali, Jean Evidence for the contribution of sulfur‒bromine intramolecular interactions to the self-rigidification of thiophene-based π-conjugated systems New Journal of Chemistry, 2008, 32, 932 |
7054124 | CIF | C10 H7 Cl N O3.5 | P n a 21 | 20.874; 20.426; 4.638 90; 90; 90 | 1978 | 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 |
7050421 | CIF | C10 H7 N | P 1 21/c 1 | 5.9188; 12.03; 11.026 90; 104.17; 90 | 761.2 | Khan, Muhammad S.; Al-Mandhary, Muna R. A.; Al-Suti, Mohammed K.; Corcoran, Timothy C.; Al-Mahrooqi, Yaqoub; Attfield, J. Paul; Feeder, Neil; David, William I. F.; Shankland, Kenneth; Friend, Richard H.; Köhler, Anna; Marseglia, Elisabeth A.; Tedesco, Emilio; Tang, Chiu C.; Raithby, Paul R.; Collings, Jonathan C.; Roscoe, Karl P.; Batsanov, Andrei S.; Stimson, Lorna M.; Marder, Todd B. Synthesis and optical characterisation of platinum(ii) poly-yne polymers incorporating substituted 1,4-diethynylbenzene derivatives and an investigation of the intermolecular interactions in the diethynylbenzene molecular precursorsElectronic supplementary information (ESI) available: atomic cooordinates for 6 and 7. See http://www.rsc.org/suppdata/nj/b2/b206946f/ New Journal of Chemistry, 2003, 27, 140 |
7054158 | CIF | C10 H7 N O6 | P -1 | 7.189; 7.5; 9.557 82.788; 87.499; 64.972 | 463.2 | Loots, Leigh; Haynes, Delia A.; Roex, Tanya le Synthesis and solid-state supramolecular chemistry of a series of pyridinium-derived zwitterions New Journal of Chemistry, 2014, 38, 2778 |
7052839 | CIF | C10 H7 N7 O11 | P 1 21 1 | 6.2866; 11.646; 10.3067 90; 93.367; 90 | 753.3 | Smiglak, Marcin; Hines, C. Corey; Reichert, W. Matthew; Vincek, Adam S.; Katritzky, Alan R.; Thrasher, Joseph S.; Sun, Luyi; McCrary, Parker D.; Beasley, Preston A.; Kelley, Steven P.; Rogers, Robin D. Synthesis, limitations, and thermal properties of energetically-substituted, protonated imidazolium picrate and nitrate salts and further comparison with their methylated analogs New Journal of Chemistry, 2012, 36, 702 |
7051462 | CIF | C10 H75 Mn Mo12 N10 Na O69 P8 | P -1 | 12.047; 14.647; 21.254 80.68; 83.04; 76.34 | 3582.7 | New Journal of Chemistry, 1999 |
7050741 | CIF | C10 H8 Ag N2 O6 S8 | C 1 c 1 | 27.637; 4.273; 18.839 90; 125.52; 90 | 1810.7 | Jia, Chunyang; Liu, Cai-Ming; Xu, Wei; Zhang, Deqing; Zhu, Daoben; Huaiming Hu Novel silver (I) complexes derived from tetrakis(methylthio)- tetrathiafulvalene and bis(ethylenedithio)tetrathiafulvalene with 3D and 1D structures New Journal of Chemistry, 2002 |
7051392 | CIF | C10 H8 Ag N3 O2 | P 1 2/n 1 | 7.2931; 6.087; 11.481 90; 102.871; 90 | 496.8 | New Journal of Chemistry, 1999 |
7050095 | CIF | C10 H8 Ag N5 O3 | C 1 2/c 1 | 25.0213; 9.3011; 15.9564 90; 109.683; 90 | 3496.49 | Kennedy, Alan R.; Brown, Karen G.; Graham, Duncan; Kirkhouse, Jennifer B.; Kittner, Madeleine; Major, Claire; McHugh, Callum J.; Murdoch, Paul; Smith, W. Ewen Chromophore containing bipyridyl ligands. Part 1: supramolecular solid-state structure of Ag(i) complexes New Journal of Chemistry, 2005, 29, 826 |
7060869 | CIF | C10 H8 Br N S2 | P 1 21/n 1 | 8.003; 11.3382; 12.9419 90; 106.882; 90 | 1123.73 | Farran, Daniel; Vanthuyne, Nicolas; Bossa, Giulia; Belot, Vincent; Albalat, Muriel; Jean, Marion; Roussel, Christian Slight structural modulation around a pivotal bond: high impact on enantiomeric stability New Journal of Chemistry, 2021, 45, 16039-16047 |
7051487 | CIF | C10 H8 Br N3 O | P 1 21/c 1 | 11.263; 6.863; 14.267 90; 94.01; 90 | 1100.1 | New Journal of Chemistry, 1999 |
7061874 | CIF | C10 H8 Br2 Co N2 Te2 | P b c a | 13.9956; 15.6522; 27.3451 90; 90; 90 | 5990.3 | da Silva, Felipe Dornelles; Bortolotto, Tanize; Tirloni, Bárbara; Daudt, Natália de Freitas; Lang, Ernesto Schulz; Cargnelutti, Roberta Bis(2-pyridyl)ditellane as a precursor to CoII, CuI and CuII complex formation: structural characterization and photocatalytic studies New Journal of Chemistry, 2022, 46, 18165-18172 |
7055215 | CIF | C10 H8 Cl N3 O2 | P 1 21/c 1 | 12.577; 8.509; 20.565 90; 102.9; 90 | 2145 | Bustos, Carlos; Molins, Elies; Cárcamo, Juan-Guillermo; Aguilar, Marcelo N.; Sánchez, Christian; Moreno-Villoslada, Ignacio; Nishide, Hiroyuki; Zarate, Ximena; Schott, Eduardo A family of substituted hydrazonoisoxazolones with potential biological properties New J. Chem., 2016, 40, 2156 |
7055216 | CIF | C10 H8 Cl N3 O2 | P -1 | 7.642; 7.933; 9.511 98.77; 104.53; 98.06 | 541.945 | Bustos, Carlos; Molins, Elies; Cárcamo, Juan-Guillermo; Aguilar, Marcelo N.; Sánchez, Christian; Moreno-Villoslada, Ignacio; Nishide, Hiroyuki; Zarate, Ximena; Schott, Eduardo A family of substituted hydrazonoisoxazolones with potential biological properties New J. Chem., 2016, 40, 2156 |
7056926 | CIF | C10 H8 Cl2 Co N2 S | P 1 21/c 1 | 12.289; 7.6775; 14.314 90; 110.8; 90 | 1262.5 | 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 |
7061871 | CIF | C10 H8 Cl2 Co N2 Te2 | P 1 21/n 1 | 8.4278; 12.123; 13.753 90; 92.779; 90 | 1403.49 | da Silva, Felipe Dornelles; Bortolotto, Tanize; Tirloni, Bárbara; Daudt, Natália de Freitas; Lang, Ernesto Schulz; Cargnelutti, Roberta Bis(2-pyridyl)ditellane as a precursor to CoII, CuI and CuII complex formation: structural characterization and photocatalytic studies New Journal of Chemistry, 2022, 46, 18165-18172 |
7062616 | CIF | C10 H8 Cl2 Cu2 N2 | P 1 21/c 1 | 3.7727; 12.743; 11.4596 90; 94.32; 90 | 549.36 | Yang, Shaolong; Chen, Yuhuan; Li, Shixiong; Chen, Huijun Efficient photocatalytic performance and the mechanism of copper(i) metal–organic framework nanosheets New Journal of Chemistry, 2023, 47, 15348-15356 |
7060812 | CIF | C10 H8 Cu Mo2 N2 O7 | P 1 21/c 1 | 17.1238; 10.8013; 7.3539 90; 94.571; 90 | 1355.85 | Zhang, Baoyue; Ying, Jun; Zhang, Xinyue; Wang, Chen; Tian, Aixiang Electrocatalytic, photocatalytic, fluorescence sensing and CO2RR properties of a series of homopolymolybdate hybrid coordination polymers New Journal of Chemistry, 2021, 45, 13340-13348 |
7050035 | CIF | C10 H8 Cu N4 O6 | P 43 21 2 | 7.8122; 7.8122; 20.232 90; 90; 90 | 1234.8 | Lu, Jack Y.; Fernandez, Wifredo A.; Ge, Zhenghua; Abboud, Khalil A. A novel two-fold interpenetrating 3D 42.84 network self-assembled from a new 1D coordination polymer New Journal of Chemistry, 2005, 29, 434 |
7061487 | CIF | C10 H8 Fe N8 Ni | I m m a | 14.5159; 7.2602; 13.1876 90; 90; 90 | 1389.8 | Kosone, Takashi; Kosuge, Ryota; Tanaka, Morie; Kawasaki, Takeshi; Adachi, Naoya New family of Hofmann-like coordination polymers constructed with imidazole ligands and associated with spin crossover and anisotropic thermal expansions New Journal of Chemistry, 2022, 46, 10540-10544 |
7061233 | CIF | C10 H8 Hg N2 S2 | C 1 2 1 | 15.0093; 4.0809; 11.0604 90; 125.104; 90 | 554.24 | Lobana, Tarlok S.; Sandhu, Amanpreet K.; Hundal, Geeta; Jasinski, Jerry P. Heterocyclic-2-thione derivatives of metals incorporating cyclopalladated azobenzenes of variable nuclearity and N,S-bridged 1D polymer of [bis(pyridine-2-thiolato)mercury(ii)] New Journal of Chemistry, 2022, 46, 2722-2729 |
7055078 | CIF | C10 H8 I2 O2 | C 1 2/c 1 | 20.5998; 7.1799; 18.253 90; 120.835; 90 | 2318.1 | Hettstedt, Christina; Mayer, Peter; Karaghiosoff, Konstantin Halogen bonding in the crystal structures of 1,2-diiodo alkenes New J. Chem., 2015, 39, 8522 |
7055972 | CIF | C10 H8 N14 O10 | P -1 | 7.6518; 7.7243; 9.0083 95.49; 106.941; 117.039 | 437.09 | Tian, Jiawei; Xiong, Hualin; Lin, Qiuhan; Cheng, Guangbin; Yang, Hongwei Energetic compounds featuring bi(1,3,4-oxadiazole): a new family of insensitive energetic materials New J. Chem., 2017, 41, 1918 |
7053819 | CIF | C10 H8 N2 O | P -1 | 7.6509; 9.1569; 12.0975 102.228; 93.332; 99.815 | 812.26 | Johnston, Karen A.; McNab, Hamish Synthesis and properties of 5,6-dihydrodipyrrolo[1,2-d;2′,1′-g][1,4]diazepin-11-one New Journal of Chemistry, 2009, 33, 1703 |
7056439 | CIF | C10 H8 N2 O | P 1 21/c 1 | 10.498; 11.412; 17.061 90; 114.079; 90 | 1866.1 | Narendar Reddy, Thatikonda; raktani, bikshapathi; Perla, Ramesh; Ravinder, Mettu; Vaidya, Jayathirtha Rao; Nanubolu, Jagadeesh Babu An efficient catalyst-free one-pot synthesis of primary amides from aldehydes of Baylis-Hillman Reaction New J. Chem., 2017 |
7052188 | CIF | C10 H8 N2 S2 | P 1 21/n 1 | 9.6504; 11.4015; 9.651 90; 100.871; 90 | 1042.83 | Ghazzali, Mohamed; Langer, Vratislav; Lopes, Cesar; Eriksson, Anders; Öhrström, Lars Syntheses, crystal structures, optical limiting properties, and DFT calculations of three thiophene-2-aldazine Schiff base derivatives New Journal of Chemistry, 2007, 31, 1777 |
7059452 | CIF | C10 H8 N2 Se | P -1 | 5.7164; 8.4317; 10.384 105.276; 105.188; 98.713 | 452.69 | Chaudhari, K. R.; Kunwar, A.; Bhuvanesh, N.; Dey, S. Synthesis and anti-proliferative activities of amine capped Pd and Pt macrocycles of 4,4′-dipyridylselenides New Journal of Chemistry, 2020, 44, 7329-7337 |
7054745 | CIF | C10 H8 N3 O6 V | C 1 2 1 | 9.3492; 12.426; 6.436 90; 129.421; 90 | 577.59 | Koleša-Dobravc, Tanja; Meden, Anton; Perdih, Franc Influence of noncovalent interactions on the structures of metal‒organic hybrids based on a [VO2(2,6-pydc)]−tecton with cations of imidazole, pyridine and its derivatives New J. Chem., 2015, 39, 4265 |
7059002 | CIF | C10 H8 N4 O2 | P 21 21 21 | 7.0748; 8.1131; 16.9559 90; 90; 90 | 973.24 | Eddahmi, Mohammed; Moura, Nuno M. M.; Bouissane, Latifa; Gamouh, Ahmed; Faustino, Maria A. F.; Cavaleiro, José A. S.; Paz, Filipe A. A.; Mendes, Ricardo F.; Lodeiro, Carlos; Santos, Sérgio M.; Neves, Maria G. P. M. S.; Rakib, El Mostapha New nitroindazolylacetonitriles: efficient synthetic access via vicarious nucleophilic substitution and tautomeric switching mediated by anions New Journal of Chemistry, 2019, 43, 14355 |
7059003 | CIF | C10 H8 N4 O2 | C m c e | 6.5388; 18.888; 15.6064 90; 90; 90 | 1927.5 | Eddahmi, Mohammed; Moura, Nuno M. M.; Bouissane, Latifa; Gamouh, Ahmed; Faustino, Maria A. F.; Cavaleiro, José A. S.; Paz, Filipe A. A.; Mendes, Ricardo F.; Lodeiro, Carlos; Santos, Sérgio M.; Neves, Maria G. P. M. S.; Rakib, El Mostapha New nitroindazolylacetonitriles: efficient synthetic access via vicarious nucleophilic substitution and tautomeric switching mediated by anions New Journal of Chemistry, 2019, 43, 14355 |
7059004 | CIF | C10 H8 N4 O2 | P 1 21/c 1 | 9.217; 16.827; 6.6121 90; 109.778; 90 | 965 | Eddahmi, Mohammed; Moura, Nuno M. M.; Bouissane, Latifa; Gamouh, Ahmed; Faustino, Maria A. F.; Cavaleiro, José A. S.; Paz, Filipe A. A.; Mendes, Ricardo F.; Lodeiro, Carlos; Santos, Sérgio M.; Neves, Maria G. P. M. S.; Rakib, El Mostapha New nitroindazolylacetonitriles: efficient synthetic access via vicarious nucleophilic substitution and tautomeric switching mediated by anions New Journal of Chemistry, 2019, 43, 14355 |
7059005 | CIF | C10 H8 N4 O2 | P 1 21/c 1 | 9.5041; 10.9669; 9.178 90; 94.857; 90 | 953.2 | Eddahmi, Mohammed; Moura, Nuno M. M.; Bouissane, Latifa; Gamouh, Ahmed; Faustino, Maria A. F.; Cavaleiro, José A. S.; Paz, Filipe A. A.; Mendes, Ricardo F.; Lodeiro, Carlos; Santos, Sérgio M.; Neves, Maria G. P. M. S.; Rakib, El Mostapha New nitroindazolylacetonitriles: efficient synthetic access via vicarious nucleophilic substitution and tautomeric switching mediated by anions New Journal of Chemistry, 2019, 43, 14355 |
7059006 | CIF | C10 H8 N4 O2 | P 1 21/n 1 | 7.6034; 14.7108; 8.7184 90; 100.023; 90 | 960.29 | Eddahmi, Mohammed; Moura, Nuno M. M.; Bouissane, Latifa; Gamouh, Ahmed; Faustino, Maria A. F.; Cavaleiro, José A. S.; Paz, Filipe A. A.; Mendes, Ricardo F.; Lodeiro, Carlos; Santos, Sérgio M.; Neves, Maria G. P. M. S.; Rakib, El Mostapha New nitroindazolylacetonitriles: efficient synthetic access via vicarious nucleophilic substitution and tautomeric switching mediated by anions New Journal of Chemistry, 2019, 43, 14355 |
7059121 | CIF | C10 H8 N6 O4 Sn | I 1 2/c 1 | 11.9805; 9.1305; 12.6134 90; 116.631; 90 | 1233.4 | Karmakar, Anirban; Hazra, Susanta; Rúbio, Guilherme M. D. M.; Guedes da Silva, M. Fátima C.; Pombeiro, Armando J. L. Packing polymorphism in 3-amino-2-pyrazinecarboxylate based tin(ii) complexes and their catalytic activity towards cyanosilylation of aldehydes New Journal of Chemistry, 2018, 42, 17513 |
7059122 | CIF | C10 H8 N6 O4 Sn | P 1 21/c 1 | 8.2366; 9.4181; 16.5098 90; 100.057; 90 | 1261.04 | Karmakar, Anirban; Hazra, Susanta; Rúbio, Guilherme M. D. M.; Guedes da Silva, M. Fátima C.; Pombeiro, Armando J. L. Packing polymorphism in 3-amino-2-pyrazinecarboxylate based tin(ii) complexes and their catalytic activity towards cyanosilylation of aldehydes New Journal of Chemistry, 2018, 42, 17513 |
7051247 | CIF | C10 H8 O2 | P b c a | 8.8316; 5.9003; 15.6123 90; 90; 90 | 813.54 | Laxmi Madhavi, N. N.; Bilton, Clair; Howard, Judith A. K.; Allen, Frank H.; Nangia, Ashwini; Desiraju, Gautam R. Seeking structural repetitivity in systems with interaction interference: crystal engineering in the gem-alkynol family New Journal of Chemistry, 2000, 24, 1 |
7056781 | CIF | C10 H9 Cl2 N O2 S | P 21 21 21 | 6.979; 8.4645; 19.895 90; 90; 90 | 1175.3 | Jagtap, Rohidas M.; Thorat, Shridhar H.; Gonnade, Rajesh G.; Khan, Ayesha A.; Pardeshi, Satish K. X-ray crystal structures and anti-breast cancer property of 3-tert-butoxycarbonyl-2-arylthiazolidine-4-carboxylic acids New Journal of Chemistry, 2018, 42, 1078 |
7050001 | CIF | C10 H9 Cu2 N7 | C 1 2/c 1 | 5.8736; 17.266; 12.983 90; 93.4; 90 | 1314.3 | Colacio, Enrique; Lloret, Francesc; Navarrete, Miguel; Romerosa, Antonio; Stoeckli-Evans, Helen; Suarez-Varela, José 2D and 3D coordination polymers based on 2,2′-bipyrimidine and cyanide bridging ligands incorporating coordinated and guest ammonia molecules. Synthesis, crystal structures, magnetic properties and thermal analysis of {[Ni(CN)4]2[(Ni(NH3)2)2(bpym)]·2H2O}n and {[Cu2(CN)2(bpym)]·NH3}n New Journal of Chemistry, 2005, 29, 1189 |
7057348 | CIF | C10 H9 F2 I N | P -1 | 8.2478; 8.7243; 8.9978 88.673; 64.626; 66.878 | 529.73 | 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 |
7057356 | CIF | C10 H9 F4 I2 N O | P 1 21/m 1 | 9.3023; 7.2775; 20.5704 90; 96.422; 90 | 1383.83 | 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 |
7053743 | CIF | C10 H9 F6 N3 O4 S2 | P 1 21/n 1 | 8.226; 15.886; 12.553 90; 91.871; 90 | 1640 | 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 |
7053744 | CIF | C10 H9 F6 N3 O4 S2 | P 21 21 21 | 12.29; 13.837; 19.51 90; 90; 90 | 3318 | 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 |
7053739 | CIF | C10 H9 F9 N2 O4 S2 | P -1 | 10.8446; 12.866; 13.2369 90.366; 90.689; 114.836 | 1675.8 | 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 |
7054159 | CIF | C10 H9 N O7 | P -1 | 7.344; 7.851; 9.78 91.428; 94.012; 106.401 | 539 | Loots, Leigh; Haynes, Delia A.; Roex, Tanya le Synthesis and solid-state supramolecular chemistry of a series of pyridinium-derived zwitterions New Journal of Chemistry, 2014, 38, 2778 |
7056102 | CIF | C10 H9 N17 O18 | P 1 21 1 | 8.3515; 11.4299; 11.9398 90; 98.663; 90 | 1126.73 | Ma, Qing; Jiang, Tao; Chi, Yu; Chen, Ya; Wang, Jun; Huang, Jinglun; Nie, Fude A novel multi-nitrogen 2,4,6,8,10,12-hexanitrohexaazaisowurtzitane based energetic cocrystal with 1-methyl-3,4,5-trinitropyrazole as a donor: experimental and theoretical investigations of intermolecular interactions New J. Chem., 2017 |
7055835 | CIF | C10 H9 N3 O2 | P 1 21/n 1 | 4.7366; 11.1769; 18.966 90; 97.015; 90 | 996.55 | Zhang, Zhenfeng; Wang, Li; Xuan, Xiaopeng The CN⋯C‒X σ-hole interaction acts as a conformational lock New J. Chem., 2017, 41, 42 |
7055836 | CIF | C10 H9 N3 O2 | P 1 21/n 1 | 4.5944; 9.3525; 22.972 90; 94.883; 90 | 983.5 | Zhang, Zhenfeng; Wang, Li; Xuan, Xiaopeng The CN⋯C‒X σ-hole interaction acts as a conformational lock New J. Chem., 2017, 41, 42 |
7061606 | CIF | C10 H9 N3 O3 | P -1 | 6.3645; 7.7209; 11.7329 94.916; 97.452; 113.275 | 519.19 | Opačak, Saša; Perić, Berislav; Gojšić, Tomislav; Čikoš, Ana; Vikić-Topić, Dražen; Kirin, Srećko I. Tandem amide coupling and hydroamination: unexpected benzotriazole oxide addition to the propiolic acid triple bond New Journal of Chemistry, 2022, 46, 13275-13285 |
7061607 | CIF | C10 H9 N3 O3 | P 1 21/c 1 | 7.555; 18.3095; 7.8064 90; 105.678; 90 | 1039.67 | Opačak, Saša; Perić, Berislav; Gojšić, Tomislav; Čikoš, Ana; Vikić-Topić, Dražen; Kirin, Srećko I. Tandem amide coupling and hydroamination: unexpected benzotriazole oxide addition to the propiolic acid triple bond New Journal of Chemistry, 2022, 46, 13275-13285 |
7052841 | CIF | C10 H9 N5 O7 | P 1 21/c 1 | 8.018; 5.8847; 27.215 90; 94.798; 90 | 1279.6 | Smiglak, Marcin; Hines, C. Corey; Reichert, W. Matthew; Vincek, Adam S.; Katritzky, Alan R.; Thrasher, Joseph S.; Sun, Luyi; McCrary, Parker D.; Beasley, Preston A.; Kelley, Steven P.; Rogers, Robin D. Synthesis, limitations, and thermal properties of energetically-substituted, protonated imidazolium picrate and nitrate salts and further comparison with their methylated analogs New Journal of Chemistry, 2012, 36, 702 |
7061285 | CIF | C10.4 H14 O0.8 P0.4 Se0.4 | P n a 21 | 17.57166; 14.50525; 9.46339 90; 90; 90 | 2412.04 | Lamola, Jairus L.; Adeyinka, Adedapo S.; Malan, Frederick P.; Moshapo, Paseka T.; Holzapfel, Cedric W.; Maumela, Munaka Christopher Exploring steric and electronic parameters of biaryl phosphacycles New Journal of Chemistry, 2022, 46, 4677-4686 |
7058199 | CIF | C10.5 H8 Cl O | P b c n | 11.1071; 8.2385; 19.1755 90; 90; 90 | 1754.67 | Kar, Swayamsiddha; Shivalingegowda, Naveen; Krishnappagowda, Lokanath Neratur; Golakoti, Nageswara Rao SiCl4 mediated one-pot synthesis of novel spirobibenzopyrans as potent anticancer agents New Journal of Chemistry, 2019, 43, 4669 |
7050666 | CIF | C10.67 H21.33 Br4 Cl1.33 S4 Sn | P -1 | 11.2865; 11.5634; 13.3067 104.865; 103.475; 92.859 | 1621.19 | Levason, William; Matthews, Melissa L.; Patel, Rina; Reid, Gillian; Webster, Michael Unusual structural variations within a family of thioether macrocyclic complexes. Tin(iv) halide adducts of [12]-, [14]- and [16]-aneS4 New Journal of Chemistry, 2003, 27, 1784 |
7052744 | CIF | C100 H116 Cl8 F12 Fe2 N2 P6 | P -1 | 11.32; 14.2718; 16.4565 105.105; 107.197; 95.493 | 2408.64 | Justaud, Frederic; Roisnel, Thierry; Lapinte, Claude Novel 2,2′-bipyridine containing two (η2-dppe)(η5-C5Me5)Fe‒CC‒ redox-active units with an exceptionally spatially demanding substitution pattern New Journal of Chemistry, 2011, 35, 2219 |
7061134 | CIF | C100 H124 Mo6 O19 P6 S8 | P -1 | 14.2549; 15.2377; 17.0827 98.206; 108.992; 114.838 | 3010.5 | Novikova, Evgeniya D.; Gassan, Alena D.; Ivanov, Anton A.; Vorotnikov, Yuri A.; Shestopalov, Michael A. Neutral Mo6Q8-clusters with terminal phosphane ligands – a route to water-soluble molecular units of Chevrel phases New Journal of Chemistry, 2022, 46, 2218-2223 |
7061135 | CIF | C100 H124 Mo6 O19 P6 Se8 | P -1 | 14.3781; 15.2185; 17.2172 97.527; 109.711; 114.89 | 3048.4 | Novikova, Evgeniya D.; Gassan, Alena D.; Ivanov, Anton A.; Vorotnikov, Yuri A.; Shestopalov, Michael A. Neutral Mo6Q8-clusters with terminal phosphane ligands – a route to water-soluble molecular units of Chevrel phases New Journal of Chemistry, 2022, 46, 2218-2223 |
7056067 | CIF | C100 H128 B2 F8 N4 O8 Pd S16 | P -1 | 17.4676; 17.8158; 20.064 74.016; 67.644; 89.049 | 5524 | Croué, V.; Krykun, S.; Allain, M.; Morille, Y.; Aubriet, F.; Carré, V.; Voitenko, Z.; Goeb, S.; Sallé, M. A self-assembled M2L4 cage incorporating electron-rich 9-(1,3-dithiol-2-ylidene)fluorene units New J. Chem., 2017, 41, 3238 |
7058837 | CIF | C100 H128 N4 O14 Sn4 | P -1 | 11.4406; 13.4384; 17.7025 78.369; 74.699; 68.198 | 2421.03 | Vinayak, Richa; Nayek, Hari Pada Selective sensing of a Cu(ii) ion by organotin anchored keto-enamine ligands New Journal of Chemistry, 2019, 43, 16050 |
7051760 | CIF | C100 H154 Er2 O70 P2 S8 | P -1 | 15.57; 21.425; 22.794 75.66; 84.2; 77.09 | 7172 | Makha, Mohamed; Alias, Yatimah; Raston, Colin L.; Sobolev, Alexandre N. Nanoporous materials based on heteroleptic bilayers built up from bisphosphonium, p-sulfonatocalix[4]arene ions New Journal of Chemistry, 2008, 32, 83 |
7055901 | CIF | C100 H52 Cl40 Mn12 O52 | P -1 | 19.829; 23.556; 23.62 109.625; 111.342; 98.625 | 9202 | Kushch, Lyudmila A.; Kazakova, Anna V.; Mironova, Svetlana A.; Yagubskii, Eduard B.; Simonov, Sergey V.; Zorina, Leokadiya V.; Shibaeva, Rimma P.; Sadakov, Andrey V.; Mironov, Vladimir S. A perylene complex with a one-dimensional coordination polymer containing [Mn6O2(CHCl2COO)10(H2O)2] cluster units linked by 3,10-perylenequinone bridges New J. Chem., 2017, 41, 793 |
7058366 | CIF | C100 H62 F12 Ir2 N8 O P2 S4 | P n a 21 | 24.7841; 20.5732; 8.1565 90; 90; 90 | 4158.9 | Su, Ning; Yang, Hui-Qing; Zheng, You-Xuan; Chen, Zhao-Xu Sulfur atom containing ligands induced rapid room temperature synthesis of red iridium(iii) complexes with Ir‒S‒P‒S structures for OLEDs New Journal of Chemistry, 2019, 43, 8722 |
7062331 | CIF | C100 H80 B2 Cl4 Cu2 F8 N8 O2 P4 | P -1 | 14.1686; 17.2839; 22.4313 67.431; 76.762; 86.734 | 4934.8 | Tong, Jin; Zhao, Li-Rong; Zhang, Jin; Wang, Xia-Yan; Yu, Yan-Min; Yu, Shu-Yan Heteroleptic copper(i) complexes bearing functionalized 1H-pyrazole-bipyridine ligands: synthesis, photophysical properties, crystal structures, and applications in halogen sensing New Journal of Chemistry, 2023, 47, 4374-4385 |
7061457 | CIF | C100 H81 Ag Br Cl9 Cu N5 O6 P4 | P 1 21/c 1 | 18.887; 18.8; 27.414 90; 100.064; 90 | 9584 | Wu, Zhan; Cui, Shu; Zhao, Zhenqin; He, Bingling; Li, Xiu-Ling Photophysical properties of homobimetallic Cu(i)–Cu(i) and heterobimetallic Cu(i)–Ag(i) complexes of 2-(6-bromo-2-pyridyl)-1H-imidazo[4,5-f][1,10]phenanthroline New Journal of Chemistry, 2022, 46, 8881-8891 |
7061456 | CIF | C100 H89 Br Cl5 Cu2 N5 O10 P4 | P 1 c 1 | 13.8873; 10.6708; 31.655 90; 96.56; 90 | 4660.2 | Wu, Zhan; Cui, Shu; Zhao, Zhenqin; He, Bingling; Li, Xiu-Ling Photophysical properties of homobimetallic Cu(i)–Cu(i) and heterobimetallic Cu(i)–Ag(i) complexes of 2-(6-bromo-2-pyridyl)-1H-imidazo[4,5-f][1,10]phenanthroline New Journal of Chemistry, 2022, 46, 8881-8891 |
7053008 | CIF | C100.5 H12 F60 | P -1 | 14.7468; 15.55; 18.135 78.495; 82.54; 71.023 | 3844.1 | Ignat'eva, D. V.; Goryunkov, A. A.; Tamm, N. B.; Ioffe, I. N.; Sidorov, L. N.; Troyanov, S. I. Isolation and structural characterization of the most highly trifluoromethylated C70 fullerenes: C70(CF3)18 and C70(CF3)20 New Journal of Chemistry, 2013, 37, 299 |
7055110 | CIF | C100.5 H71.5 B3 F12 N6 O1.83 | P -1 | 13.677; 16.455; 19.539 70.956; 76.3; 87.68 | 4035 | Ninomiya, Kazuki; Harada, Yumi; Kanetou, Tomoaki; Suenaga, Yuma; Murafuji, Toshihiro; Tsunashima, Ryo Synthesis and acid‒base properties of a proton-bridged biaryl compound based on pyridylazulene New J. Chem., 2015, 39, 9079 |
7058058 | CIF | C101 H118 N21 O9 P3 Pd3 S3 | P -1 | 13.502; 14.691; 29.759 97.088; 92.815; 112.468 | 5383 | Saxena, Priya; Thomas, Jisha Mary; Sivasankar, Chinnappan; Thirupathi, Natesan Syntheses and structural aspects of six-membered palladacyclic complexes derived from N,N′,N′′-triarylguanidines with N- or S-thiocyanate ligands New Journal of Chemistry, 2019, 43, 2307 |
7056399 | CIF | C101 H176 Cu8 N8 O39 | P -1 | 12.548; 12.7661; 22.424 92.579; 93.385; 117.938 | 3157.1 | Sanyal, Ria; Ketkov, Sergey Yu.; Purkait, Suranjana; Mautner, Franz Andreas; Zhigulin, Grigory; Das, Debasis Nuclearity dependent solvent contribution on the catechol oxidase activity of novel Copper(II) complexes derived from Mannich-base ligand platforms: synthesis, crystal structure and mechanism New J. Chem., 2017 |
7054275 | CIF | C101 H97 Cl3 N6 O8 | P -1 | 11.1735; 11.7304; 17.822 100.46; 99.693; 107.086 | 2133.8 | Collins, Carleton G.; Johnson, Andrew T.; Connell, Richard D.; Nelson, Ruth A.; Murgu, Ivan; Oliver, Allen G.; Smith, Bradley D. Effect of 1,3-adamantane bridging units within the surrounding macrocycle of squaraine rotaxanes New Journal of Chemistry, 2014, 38, 3992 |
7059047 | CIF | C102 H104 Cl6 K2 N36 O12 | P -1 | 13.7277; 19.2901; 23.1243 66.352; 74.863; 89.576 | 5381.8 | Konarev, Dmitri V.; Faraonov, Maxim A.; Kuz`min, Alexey V.; Osipov, Nikita G.; Khasanov, Salavat S.; Otsuka, Akihiro; Yamochi, Hideki; Kitagawa, Hiroshi; Lyubovskaya, Rimma N. Molecular structure, optical and magnetic properties of free-base tetrapyrazinoporphyrazine in various reduction states New Journal of Chemistry, 2019 |
7050844 | CIF | C102 H104 N2 O22 U2 | P 1 21/n 1 | 25.3546; 13.8369; 28.0625 90; 112.456; 90 | 9098.6 | Thuery, Pierre; Masci, B.; Nierlich, M. Supramolecular assemblies from uranyl ion complexes of hexahomotrioxacalix[3]arenes and protonated [2.2.2]cryptand New Journal of Chemistry, 2002 |
7050415 | CIF | C102 H106 Cl4 Cu4 Mn2 N22 O29 | P -1 | 14.582; 15.677; 25.158 87.217; 75.768; 78.204 | 5457 | Liu, Zhi-Liang; Li, Li-Cun; Zhang, Lei; Liao, Dai-Zheng; Jiang, Zong-Hui; Yan, Shi-Ping A novel heterospin polynuclear complex containing both macrocyclic and imino nitroxide radical ligands: {[CuL(H2O)](CuL)Mn(IM-2Py)}{[CuL(MeOH)](CuL)Mn(IM-2Py)}(ClO4)4·MeOH New Journal of Chemistry, 2003, 27, 583 |
7062367 | CIF | C102 H114 F12 Fe2 N6 P6 Ru | P 1 21 1 | 15.273; 17.4784; 19.053 90; 105.506; 90 | 4901.03 | Qian, Wang; Liu, Xiao-Lin; Tan, Bing-Chang; Song, Ying; Jiang, Long-Long; Wu, Xin-Tao; Sheng, Tian-Lu MMCT energy change in cyanidometal-bridged trinuclear complexes by changing the ligand electron donating ability New Journal of Chemistry, 2023, 47, 7134-7142 |
7062372 | CIF | C102 H114 F24 Fe2 N6 P8 Ru | P 1 21/n 1 | 14.7436; 28.0448; 27.1179 90; 101.088; 90 | 11003.4 | Qian, Wang; Liu, Xiao-Lin; Tan, Bing-Chang; Song, Ying; Jiang, Long-Long; Wu, Xin-Tao; Sheng, Tian-Lu MMCT energy change in cyanidometal-bridged trinuclear complexes by changing the ligand electron donating ability New Journal of Chemistry, 2023, 47, 7134-7142 |
7058339 | CIF | C102 H116 Cl4 Mo4 N20 O3 P2 S16 | P -1 | 10.936; 16.122; 18.503 83.009; 72.837; 88.972 | 3093.3 | Moula, Golam; Bose, Moumita; Sarkar, Sabyasachi Structurally characterized one oxo‒desoxo bridged Mo2‒bis(dithiolene) complex and its interconversion to a discrete oxo or desoxo DMSOR model New Journal of Chemistry, 2019, 43, 8332 |
7062876 | CIF | C102 H152 Cl4 K2 Mn3 N16 O12 S12 | C 1 2/c 1 | 18.542; 28.21; 24.404 90; 94.19; 90 | 12731 | Mikhailenko, Maxim V.; Ivanov, Vladislav V.; Faraonov, Maxim A.; Kuzmin, Aleksey V.; Khasanov, Salavat S.; Otsuka, Akihiro; Yamochi, Hideki; Kitagawa, Hiroshi; Konarev, Dmitri V. Manganese(ii) complexes of hexaazatrinaphthylene and hexaazatrianthracene: synthesis, structure and properties New Journal of Chemistry, 2023, 47, 22339-22349 |
7062113 | CIF | C102 H220 Br6 N12 Ni3 O44 Si6 | P -4 21 c | 31.291; 31.291; 31.796 90; 90; 90 | 31132 | Gwak, Geonwoo; An, Seonghyeon; Kim, Dongwon; Di Serio, Martino; Jung, Ok-Sang Water-reservoir properties dependent on packing modes of [Ni(ii)3L6] cages New Journal of Chemistry, 2022, 46, 23239-23244 |
7060754 | CIF | C102 H76 Eu N7 O15 Zn2 | C 1 2/c 1 | 30.502; 14.3818; 20.1905 90; 100.121; 90 | 8719.2 | Melnikov, Stanislav N.; Evstifeev, Igor S.; Nikolaveskii, Stanislav A.; Ananyev, Ivan V.; Varaksina, Evgenia A.; Taydakov, Ilya V.; Goloveshkin, Alexander S.; Sidorov, Aleksey A.; Kiskin, Mikhail A.; Eremenko, Igor L. The effect of terminal N-donor aromatic ligands on the sensitization and emission of lanthanide ions in Zn2Ln (Ln = Eu, Tb) complexes with 4-biphenylcarboxylate anions New Journal of Chemistry, 2021, 45, 13349-13359 |
7050292 | CIF | C102 H84 B2 N2 P2 S2 | P 1 21/n 1 | 9.984; 28.483; 13.85 90; 92.243; 90 | 3935.8 | Paul Kelly; Mark R Bailey; Mark R.J.Elsegood; Liam M.Gilby; Kathryn E.Holmes; Michael J.Papageorgiou; Sarah Pedron-Haba Reactions of mono- and bis-N-bromosulfimides with thio-ether crowns, phosphines and selenides New J.Chem.(Nouv.J.Chim.), 2004 |
7061292 | CIF | C102 H85 N11 O20 S4 Zn6 | C 1 2/c 1 | 41.3959; 10.3962; 26.5419 90; 121.695; 90 | 9719 | Zheng, Han-Wen; Yang, Dong-Dong; Liang, Qiong-Fang; Zheng, Xiang-Jun Acetonitrile-induced structure fine-tuning of a trinuclear zinc complex showing multistimuli responsive luminescence New Journal of Chemistry, 2022, 46, 4800-4805 |
7054708 | CIF | C102 H90 Eu N16 O19 Pb2 | P 1 21/n 1 | 12.31597; 20.8623; 18.2267 90; 91.689; 90 | 4681.12 | Pan, Mei; Yan, Cheng; Chen, Ling; Zhang, Lu-Yin; Yin, Shao-Yun; Zhu, Yi-Xuan; Wu, Kai; Hou, Ya-Jun; Su, Cheng-Yong Photoluminescence and white-light emission in two series of heteronuclear Pb(ii)‒Ln(iii) complexes New J. Chem., 2015, 39, 3770 |
7054707 | CIF | C102 H90 N16 O19 Pb2 Tb | P 1 21/n 1 | 12.3263; 20.7018; 18.2517 90; 91.642; 90 | 4655.49 | Pan, Mei; Yan, Cheng; Chen, Ling; Zhang, Lu-Yin; Yin, Shao-Yun; Zhu, Yi-Xuan; Wu, Kai; Hou, Ya-Jun; Su, Cheng-Yong Photoluminescence and white-light emission in two series of heteronuclear Pb(ii)‒Ln(iii) complexes New J. Chem., 2015, 39, 3770 |
7053023 | CIF | C102 H92 Cr3 Mn3 N18 O16 | P 1 21/c 1 | 16.039; 20.336; 16.729 90; 91.988; 90 | 5453 | Zhang, Qian; Zhou, Hongbo; Shen, Xiaoping; Zhou, Hu; Yang, Yuqi Syntheses, crystal structures and magnetic properties of four cyano-bridged bimetallic alternating chain complexes based on [CrIII(salen)(CN)2]− and [CrIII(bipy)(CN)4]− building blocks New Journal of Chemistry, 2013, 37, 941 |
7054611 | CIF | C102 H95 Al4 Cl8 N4 O8 | P b n 21 | 12.0601; 22.5938; 35.5013 90; 90; 90 | 9673.5 | Forder, Thomas R.; Jones, Matthew D. Synthesis and characterisation of aluminium(iii) imine bis(phenolate) complexes with application for the polymerisation of rac-LA New J. Chem., 2015, 39, 1974 |
7060287 | CIF | C103 H115 Cd2 N10 O28 S4 | P c a 21 | 28.6962; 16.3215; 20.524 90; 90; 90 | 9612.7 | Wang, Fei-Fei; Li, Jia-Hui; Liu, Hai-Yan; Deng, Shu-Ping; Liu, Ying-Ying; Ma, Jian-Fang Functionalized resorcin[4]arene-based coordination polymers as heterogeneous catalysts for click reactions New Journal of Chemistry, 2021, 45, 3181-3187 |
7061255 | CIF | C103 H116 F18 Fe2 N6 O P7 Ru | P 1 21/n 1 | 13.0216; 32.214; 27.028 90; 98.184; 90 | 11222 | Wang, Yong Synthesis, structural and metal-to-metal charge transfer properties of cyanide-bridged compound [FeII/III-NC-RuII-CN-FeII/III] New Journal of Chemistry, 2022, 46, 3978-3984 |
7058086 | CIF | C103.46 H46.77 Cl0.4 F30 K N2 O6 | P 1 21/n 1 | 19.095; 21.5607; 19.4136 90; 92.127; 90 | 7987.1 | Konarev, Dmitri V.; Khasanov, Salavat S.; Goryunkov, Alexey A.; Troyanov, Sergey I.; Brotsman, Victor A.; Ioffe, Ilya N.; Lyubovskaya, Rimma N. Negatively charged singly-bonded dimers of C1-[C70(CF3)10] and bare C70 fullerene New Journal of Chemistry, 2019, 43, 2726 |
7053768 | CIF | C104 H100 Cl10 Fe6 N6 O8 Pd6 | C 1 2 1 | 19.839; 14.322; 19.416 90; 99.75; 90 | 5437 | Qian, Hengyu; Cui, Xiuling; Tang, Mingsheng; Liu, Chunhui; Liu, Cheng; Wu, Yangjie Synthesis and structure of heteroannular cyclopalladated chiral ferrocenylimines: theoretical interpretation of the cyclopalladated complexes based on density functional calculations New Journal of Chemistry, 2009, 33, 668 |
7055279 | CIF | C104 H100 F12 Ir4 N12 O16 S4 | P 1 21/n 1 | 14.964; 24.495; 15.987 90; 109.982; 90 | 5507 | Yu, Wei-Bin; He, Qing-Ya; Shi, Hua-Tian; Wei, Xianwen Heterogeneous catalysis of water oxidation supported by a novel metallamacrocycle New J. Chem., 2016, 40, 2354 |
7055280 | CIF | C104 H100 F12 N12 O16 Rh4 S4 | P 1 21/n 1 | 14.94; 24.403; 15.917 90; 109.611; 90 | 5466 | Yu, Wei-Bin; He, Qing-Ya; Shi, Hua-Tian; Wei, Xianwen Heterogeneous catalysis of water oxidation supported by a novel metallamacrocycle New J. Chem., 2016, 40, 2354 |
7053118 | CIF | C104 H102 F24 N24 O19 Si4 | P 1 21/c 1 | 19.277; 9.226; 34.761 90; 116.698; 90 | 5523 | Nath, Jayanta K.; Baruah, Jubaraj B. Water assisted anion chains and anion dependent fluorescence emission in salts of N,N′-bis(3-imidazol-1-ylpropyl)naphthalenediimide New Journal of Chemistry, 2013, 37, 1509 |
7062371 | CIF | C104 H116 F24 Fe2 N6 P8 Ru | P -1 | 13.0433; 15.3889; 32.7979 94.423; 91.369; 113.667 | 6000.76 | Qian, Wang; Liu, Xiao-Lin; Tan, Bing-Chang; Song, Ying; Jiang, Long-Long; Wu, Xin-Tao; Sheng, Tian-Lu MMCT energy change in cyanidometal-bridged trinuclear complexes by changing the ligand electron donating ability New Journal of Chemistry, 2023, 47, 7134-7142 |
7051732 | CIF | C104 H118 Cl4 N52 O25 | P 1 21/c 1 | 23.9121; 17.6841; 16.8216 90; 99.475; 90 | 7016.2 | Yan, Ying; Xue, Sai-Feng; Cong, Hang; Zhang, Jian-Xing; Zhang, Yun-Qian; Zhu, Qian-Jiang; Tao, Zhu Exclusion complexes of the HCl salts of benzidine and bis(4-aminophenyl) methane with two methyl-substituted cucurbiturils New Journal of Chemistry, 2009, 33, 2136 |
7061256 | CIF | C104 H118 Cl8 F12 Fe2 N6 P6 Ru | P 1 21/c 1 | 13.838; 30.951; 25.87 90; 96.1; 90 | 11017 | Wang, Yong Synthesis, structural and metal-to-metal charge transfer properties of cyanide-bridged compound [FeII/III-NC-RuII-CN-FeII/III] New Journal of Chemistry, 2022, 46, 3978-3984 |
7062369 | CIF | C104 H118 F12 Fe2 N6 P6 Ru | P 1 21 1 | 16.2245; 17.8873; 19.2837 90; 109.935; 90 | 5261.04 | Qian, Wang; Liu, Xiao-Lin; Tan, Bing-Chang; Song, Ying; Jiang, Long-Long; Wu, Xin-Tao; Sheng, Tian-Lu MMCT energy change in cyanidometal-bridged trinuclear complexes by changing the ligand electron donating ability New Journal of Chemistry, 2023, 47, 7134-7142 |
7050280 | CIF | C104 H123 N40 O37.5 Zn4 | P -1 | 14.8166; 18.2768; 24.8929 69.9171; 75.1473; 88.2844 | 6107.1 | Sun Wei-Yin; Jian Fan; Taka-aki Okamura; Norikazu Ueyama; Wei Zhao; Hui-Fang Zhu Syntheses and Crystal Structures of 1D Tabular Chain and 2D Polycatenane Built from Asymmetric 1-(1-Imidazolyl)-4-(imidazol-1-ylmethyl)benzene Ligand with Metal Salts New J.Chem.(Nouv.J.Chim.), 2004 |
7057213 | CIF | C104 H124 N2 O22 | P -1 | 12.413; 22.404; 22.568 62.389; 77.747; 81.705 | 5427.1 | Jiang, Shuo; Han, Ying; Cheng, Ming; Sun, Jing; Yan, Chao-Guo; Jiang, Juli; Wang, Leyong Self-locked dipillar[5]arene-based pseudo[1]rotaxanes and bispseudo[1]rotaxanes with different lengths of bridging chains New Journal of Chemistry, 2018, 42, 7603 |
7051951 | CIF | C104 H136 O40 P8 | P -1 | 14.055; 14.498; 15.077 75.011; 88.677; 74.754 | 2859.9 | Clark, Thomas E.; Makha, Mohamed; Sobolev, Alexandre N.; Su, Dian; Rohrs, Henry; Gross, Michael L.; Atwood, Jerry L.; Raston, Colin L. Self-organised nano-arrays of p-phosphonic acid functionalised higher order calixarenes New Journal of Chemistry, 2008, 32, 1478 |
7055205 | CIF | C104 H68 N16 O20 Zn4 | C 1 2/c 1 | 23.2393; 25.042; 53.544 90; 94.148; 90 | 31079 | Yao, Wan-Ting; Luo, Ming-Biao; Feng, Xue-Feng; Meng, Pan-Pan; Gong, Le-Le; Luo, Feng Construction of structural diversity and fine-tuned porosity in acylamide MOFs by a synthetic approach New J. Chem., 2016, 40, 2021 |
7058853 | CIF | C104 H94 Eu2 N4 O16 | F d d d :2 | 21.821; 25.478; 40.301 90; 90; 90 | 22406 | Xu, Yuan-Yi; Sun, Ou; Qi, Yue; Xie, Bo-Yu; Gao, Ting Enhanced luminescence for detection of small molecules based on doped lanthanide compounds with a dinuclear double-stranded helicate structure New Journal of Chemistry, 2019, 43, 16706 |
7051754 | CIF | C104.5 H108 Fe6 N10 O32.5 | P -1 | 16.94; 17.775; 19.317 74.707; 80.588; 75.863 | 5410 | Feltham, Humphrey L. C.; Larsen, David S.; Brooker, Sally A hexanuclear iron(iii) complex of a hexadentate fully conjugated diimine ligand derived from 1,4-diformyl-2,3-dihydroxybenzene New Journal of Chemistry, 2009, 33, 2001 |
7053712 | CIF | C104.5 H30 F30 O4 | P -1 | 12.434; 14.692; 20.783 100.088; 93.337; 103.419 | 3616.5 | Ovchinnikova, Nataliya S.; Ignat’eva, Daria V.; Tamm, Nadezhda B.; Avdoshenko, Stanislav M.; Goryunkov, Alexey A.; Ioffe, Ilya N.; Markov, Vitaliy Yu.; Troyanov, Sergey I.; Sidorov, Lev N.; Yurovskaya, Marina A.; Kemnitz, Erhard Regioselective synthesis and crystal structure of C70(CF3)10[C(CO2Et)2] New Journal of Chemistry, 2008, 32, 89 |
7053085 | CIF | C104.9 H160.8 Cl5.8 N19 O20 P2 S2 | P 1 2/c 1 | 17.251; 12.4954; 28.007 90; 97.612; 90 | 5983.9 | Zhang, Yanlei; Zhang, Rui; Zhao, Yanxia; Ji, Liguo; Jia, Chuandong; Wu, Biao Anion binding of tris-(thio)urea ligands New Journal of Chemistry, 2013, 37, 2266 |
7062368 | CIF | C105 H122 Cl6 F24 Fe2 N6 O P8 Ru | P -1 | 15.7835; 16.419; 24.0034 74.06; 77.906; 76.95 | 5754.11 | Qian, Wang; Liu, Xiao-Lin; Tan, Bing-Chang; Song, Ying; Jiang, Long-Long; Wu, Xin-Tao; Sheng, Tian-Lu MMCT energy change in cyanidometal-bridged trinuclear complexes by changing the ligand electron donating ability New Journal of Chemistry, 2023, 47, 7134-7142 |
7062935 | CIF | C105 H127.5 Cl3 Co3 N13.5 O28.5 | R -3 :H | 38.549; 38.549; 14.249 90; 90; 120 | 18338 | Jana, Narayan Ch.; Brandão, Paula; Gomila, Rosa M.; Frontera, Antonio; Panja, Anangamohan Insight into the conformational selectivity of cobalt(iii) complexes with a tetradentate salen-type Schiff base ligand and their biorelevant catalysis: a combined experimental and theoretical study New Journal of Chemistry, 2024, 48, 2389-2402 |
7053024 | CIF | C105 H98 Cr3 Mn3 N18 O16 | P 1 21/c 1 | 15.946; 20.452; 16.9 90; 92.377; 90 | 5506.8 | Zhang, Qian; Zhou, Hongbo; Shen, Xiaoping; Zhou, Hu; Yang, Yuqi Syntheses, crystal structures and magnetic properties of four cyano-bridged bimetallic alternating chain complexes based on [CrIII(salen)(CN)2]− and [CrIII(bipy)(CN)4]− building blocks New Journal of Chemistry, 2013, 37, 941 |
7060599 | CIF | C106 H100 N8 O25 S8 Zn2 | P 1 21/c 1 | 15.823; 16.228; 22.53 90; 108.133; 90 | 5498 | Gee, William J.; Wells, Stephen A.; Teat, Simon J.; Raithby, Paul R.; Burrows, Andrew D. Using geometric simulation software ‘GASP’ to model conformational flexibility in a family of zinc metal‒organic frameworks New Journal of Chemistry, 2021, 45, 8728-8737 |
7057948 | CIF | C106 H108 Ag14 F24 N6 O22 S6 | P b c a | 17.109; 26.729; 29.365 90; 90; 90 | 13429 | Li, Yan-Ling; Xu, Qing-Qing; Li, Si; Huang, Ren-Wu; Liu, Xiao-Fei; Wei, Yong-Li; Zang, Shuang-Quan Investigating the influence of a CrO42−/Cr2O72− template in the formation of a series of silver‒chalcogenide clusters New Journal of Chemistry, 2019, 43, 115 |
7055859 | CIF | C106 H114 Cu6 N24 O29 | P 1 21/c 1 | 12.4393; 20.3403; 22.337 90; 102.641; 90 | 5514.7 | Cheng, Meiling; Sun, Lin; Han, Wei; Wang, Shen; Liu, Qi; Sun, Xiaoqiang; Xi, Haitao Effect of N ancillary ligands on the structure, nuclearity and magnetic behavior of Cu(ii)‒pyrazolecarboxylate complexes New J. Chem., 2016, 40, 10504 |
7062370 | CIF | C106 H122 F24 Fe2 N6 P8 Ru | P -1 | 12.4822; 14.6612; 17.9543 106.982; 101.599; 101.399 | 2960.78 | Qian, Wang; Liu, Xiao-Lin; Tan, Bing-Chang; Song, Ying; Jiang, Long-Long; Wu, Xin-Tao; Sheng, Tian-Lu MMCT energy change in cyanidometal-bridged trinuclear complexes by changing the ligand electron donating ability New Journal of Chemistry, 2023, 47, 7134-7142 |
7059826 | CIF | C106 H148 Cl4 O8 S4 | P 1 21 1 | 13.1174; 21.497; 18.729 90; 90.249; 90 | 5281.2 | Kortus, D.; Kundrát, O.; Tlustý, M.; Čejka, J.; Dvořáková, H.; Lhoták, P. Inherent chirality through a simple dialkylation of 2,14-dithiacalix[4]arene New Journal of Chemistry, 2020, 44, 14496-14504 |
7058488 | CIF | C106 H78 B2 F40 N6 Te2 | P 1 21/n 1 | 11.0816; 18.5142; 25.346 90; 101.538; 90 | 5095.1 | Nakata, Norio; Kawauchi, Fumihiko; Takahashi, Shintaro; Ishii, Akihiko Dicationic ditelluride salts stabilized by N-heterocyclic carbene New Journal of Chemistry, 2019, 43, 10894 |
7059616 | CIF | C106 H87 Dy4 N13 O16 S6 | P 1 21/n 1 | 15.194; 12.779; 28.304 90; 102.649; 90 | 5362.2 | Wang, Wen-Min; Huai, Lei; Wang, Xi-Wen; Jiang, Kai-Jun; Shen, Hai-Yun; Gao, Hong-Ling; Fang, Ming; Cui, Jian-Zhong Structures, magnetic refrigeration and single molecule-magnet behavior of five rhombus-shaped tetranuclear Ln(iii)-based clusters New Journal of Chemistry, 2020, 44, 10266-10274 |
7059614 | CIF | C106 H87 Gd4 N13 O16 S6 | P 1 21/n 1 | 15.115; 12.699; 28.477 90; 102.116; 90 | 5344 | Wang, Wen-Min; Huai, Lei; Wang, Xi-Wen; Jiang, Kai-Jun; Shen, Hai-Yun; Gao, Hong-Ling; Fang, Ming; Cui, Jian-Zhong Structures, magnetic refrigeration and single molecule-magnet behavior of five rhombus-shaped tetranuclear Ln(iii)-based clusters New Journal of Chemistry, 2020, 44, 10266-10274 |
7059617 | CIF | C106 H87 N13 O16 S6 Tb4 | P 1 21/n 1 | 15.1763; 12.7802; 28.3434 90; 102.579; 90 | 5365.4 | Wang, Wen-Min; Huai, Lei; Wang, Xi-Wen; Jiang, Kai-Jun; Shen, Hai-Yun; Gao, Hong-Ling; Fang, Ming; Cui, Jian-Zhong Structures, magnetic refrigeration and single molecule-magnet behavior of five rhombus-shaped tetranuclear Ln(iii)-based clusters New Journal of Chemistry, 2020, 44, 10266-10274 |
7052708 | CIF | C106.48 H116.48 Cl2.45 N5 O11 | P 1 21/n 1 | 11.498; 29.702; 31.391 90; 97.333; 90 | 10633 | Evans, Nicholas H.; Serpell, Christopher J.; Beer, Paul D. A meta-xylenediamide macrocycle containing rotaxane anion host system constructed by a new synthetic clipping methodology New Journal of Chemistry, 2011, 35, 2047 |
7059381 | CIF | C107 H124 N8 O14 Sn4 | P -1 | 12.1753; 13.8987; 15.6416 103.64; 90.895; 103.259 | 2496.86 | Debnath, Paresh; Singh, Keisham Surjit; Singh, Khaidem Kennedy; Sureshkumar Singh, S.; Sieroń, Lesław; Maniukiewicz, Waldemar Di-butyltin(iv) complexes with azo-carboxylates: synthesis, characterization, crystal structures and their anti-diabetic assay New Journal of Chemistry, 2020, 44, 5862-5872 |
7059162 | CIF | C107 H147 Cl4 Dy4 N30 O40 | P 1 21/c 1 | 20.0833; 30.421; 21.9915 90; 104.035; 90 | 13034.7 | Lu, Jingjing; Li, Xiao-Lei; Jin, Chaoyi; Yu, Yang; Tang, Jinkui Dysprosium-based linear helicate clusters: syntheses, structures, and magnetism New Journal of Chemistry, 2020, 44, 994-1000 |
7050287 | CIF | C107 H208 Cl8 O4 Si8 Sn8 | C 1 2/c 1 | 49.8011; 25.1497; 12.1328 90; 100.687; 90 | 14932.5 | Dainis Dakternieks; Jens Beckmann; Andrew Duthie; Fong Sheen Kuan Synthesis and Structures of New Alkylidene Double Ladders. How Far Can The Layers Be Separated? New J.Chem.(Nouv.J.Chim.), 2004 |
7054709 | CIF | C108 H100 N20 O28 Pb Tb2 | P -1 | 11.7061; 13.0527; 17.955 87.73; 88.01; 89.886 | 2739.65 | Pan, Mei; Yan, Cheng; Chen, Ling; Zhang, Lu-Yin; Yin, Shao-Yun; Zhu, Yi-Xuan; Wu, Kai; Hou, Ya-Jun; Su, Cheng-Yong Photoluminescence and white-light emission in two series of heteronuclear Pb(ii)‒Ln(iii) complexes New J. Chem., 2015, 39, 3770 |
7057671 | CIF | C108 H112 B2 N12 Na2 O12 | P 1 21/n 1 | 15.2728; 10.3419; 30.0963 90; 98.513; 90 | 4701.33 | 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 |
7062877 | CIF | C108 H140 Cl10 I6 K3 Mn3 N12 O18 | P -1 | 13.8553; 19.0211; 27.1938 78.617; 89.964; 70.368 | 6600.6 | Mikhailenko, Maxim V.; Ivanov, Vladislav V.; Faraonov, Maxim A.; Kuzmin, Aleksey V.; Khasanov, Salavat S.; Otsuka, Akihiro; Yamochi, Hideki; Kitagawa, Hiroshi; Konarev, Dmitri V. Manganese(ii) complexes of hexaazatrinaphthylene and hexaazatrianthracene: synthesis, structure and properties New Journal of Chemistry, 2023, 47, 22339-22349 |
7055926 | CIF | C108 H146 Cu2 N24 O37 S2 | P -1 | 14.456; 20.541; 22.843 73.881; 79.477; 88.62 | 6404 | Adarsh, N. N.; Chakraborty, Amarnath; Tarrés, Màrius; Dey, Surjendu; Novio, Fernando; Chattopadhyay, Basab; Ribas, Xavi; Ruiz-Molina, Daniel Ligand and solvent effects in the formation and self-assembly of a metallosupramolecular cage New J. Chem., 2017, 41, 1179 |
7062878 | CIF | C108 H148 Cl4 K2 Mn3 N10 O24 | P 1 21/n 1 | 16.5169; 30.5496; 24.4406 90; 105.726; 90 | 11870.7 | Mikhailenko, Maxim V.; Ivanov, Vladislav V.; Faraonov, Maxim A.; Kuzmin, Aleksey V.; Khasanov, Salavat S.; Otsuka, Akihiro; Yamochi, Hideki; Kitagawa, Hiroshi; Konarev, Dmitri V. Manganese(ii) complexes of hexaazatrinaphthylene and hexaazatrianthracene: synthesis, structure and properties New Journal of Chemistry, 2023, 47, 22339-22349 |
7050763 | CIF | C108 H154 Ag6 N24 O35 | C 1 2/c 1 | 35.8754; 17.6365; 43.1894 90; 113.531; 90 | 25054.3 | Jian Fan; Wei-Yin Sun; Taka-aki Okamura; Jin Xie; Wen-Xia Tang; Norikazu Ueyama First example of a dumbbell-like architecture containing M3L2 cages and terephthalate anions New J. Chem., 26, 199-201 |
7050080 | CIF | C108 H181 Cl16 N18 O8.5 Ru4 | C 1 c 1 | 38.252; 8.936; 40.475 90; 103.49; 90 | 13453 | Gianferrara, Teresa; Serli, Barbara; Zangrando, Ennio; Iengo, Elisabetta; Alessio, Enzo Pyridylporphyrins peripherally coordinated to ruthenium-nitrosyls, including the water-soluble Na4[Zn·4′TPyP{RuCl4(NO)}4]: synthesis and structural characterization New Journal of Chemistry, 2005, 29, 895 |
7061447 | CIF | C108 H36 Cu24 Mo10 N48 O116 Si V2 | F m -3 m | 44.361; 44.361; 44.361 90; 90; 90 | 87298 | Liu, Jiabin; Xin, Yuxiang; Bai, Yiyang; She, Wei; Wang, Jing; Li, Gaungming A self-assembly solvothermal synthesis of SiMoVn@[Cu6O(TZI)3(H2O)6]4·nH2O for the efficient selective oxidation of various alkylbenzenes New Journal of Chemistry, 2022, 46, 9229-9237 |
7062667 | CIF | C108 H64 Cd2 K O16 | P 43 21 2 | 10.02; 10.02; 88.189 90; 90; 90 | 8854.2 | Cen, Peipei; Ma, Tongtong; Jiang, Fujunrui; Zhang, Fengyuan; He, Yanping; Ding, Runmei; Tian, Danian Fluorescent cadmium(ii) metal–organic frameworks exhibit excellent stability and detection ability to Fe3+ and MnO4− ions New Journal of Chemistry, 2023, 47, 16741-16747 |
7058679 | CIF | C108 H72 N18 O30 Zn6 | F d d 2 | 39.603; 43.585; 38.789 90; 90; 90 | 66953.6 | Qin, Bo-Wen; Zhang, Xiao-Ying; Zhang, Jing-Ping A stable luminescent zinc‒organic framework as a dual-sensor toward Cu2+ and Cr2O72−, and excellent platform-encapsulated Ln3+ for systematic color tuning and white-light emission New Journal of Chemistry, 2019, 43, 13794 |
7052453 | CIF | C108 H76 B2 Cl4 F40 Li2 N2 O16 | P -1 | 10.7147; 13.4449; 19.5512 103.233; 90.1735; 94.5532 | 2732.42 | Pascu, Sofia I.; Jarrosson, Thibaut; Naumann, Christoph; Otto, Sijbren; Kaiser, Guido; Sanders, Jeremy K. M. Cation-reinforced donor-acceptor pseudorotaxanes New Journal of Chemistry, 2005, 29, 80 |
7061539 | CIF | C108 H88 Mn3 N24 O14 S6 | C 1 2/c 1 | 20.4559; 31.3664; 18.7949 90; 119.644; 90 | 10481 | Gond, M. K.; Pandey, Shivendra Kumar; Singh, R.; Bharty, Manoj K.; Manna, Partha Pratim; Singh, V. K.; Maiti, B.; Prasad, L. B.; Butcher, R. J. In vitro and In silico anticancer activities of Mn(ii), Co(ii), and Ni(ii) complexes: synthesis, characterization, crystal structures, and DFT studies New Journal of Chemistry, 2022 |
7059615 | CIF | C108 H90 Er4 N14 O16 S6 | P 1 21/n 1 | 15.189; 12.7422; 28.246 90; 102.961; 90 | 5327.5 | Wang, Wen-Min; Huai, Lei; Wang, Xi-Wen; Jiang, Kai-Jun; Shen, Hai-Yun; Gao, Hong-Ling; Fang, Ming; Cui, Jian-Zhong Structures, magnetic refrigeration and single molecule-magnet behavior of five rhombus-shaped tetranuclear Ln(iii)-based clusters New Journal of Chemistry, 2020, 44, 10266-10274 |
7059599 | CIF | C108 H92 Cl6 Ho3 N6 O18 | P 1 21/c 1 | 25.3968; 17.4468; 23.7526 90; 104.614; 90 | 10184.1 | Wang, Wen-Min; Gao, Yu; Yue, Rong-Xin; Qiao, Na; Wang, Dan-Tong; Shi, Ying; Zhang, Huan; Cui, Jian-Zhong Construction of a family of Ln3 clusters using multidentate Schiff base and β-diketonate ligands: fluorescence properties, magnetocaloric effect and slow magnetic relaxation New Journal of Chemistry, 2020, 44, 9230-9237 |
7061495 | CIF | C108 H96 Cd9 N18 O26 | P -3 | 19.3724; 19.3724; 9.8552 90; 90; 120 | 3203.04 | Shao, Juan-Juan; Ni, Jian-Ling; Mensah, Abraham; Liang, Yu; Li, Guang-Jun; Chen, Li-Zhuang; Wang, Fang-Ming Anion-induced two stable isostructural Cd(ii) LMOFs based on benzotriazole with the highly selective detection of Fe3+ ions New Journal of Chemistry, 2022, 46, 10927-10933 |
7055008 | CIF | C109 H132 La4 O47 | P -1 | 15.2502; 16.6406; 25.6709 89.014; 78.289; 64.668 | 5747.7 | Deacon, Glen B.; Junk, Peter C.; Lee, Winnie W.; Forsyth, Maria; Wang, Jun Rare earth 3-(4′-hydroxyphenyl)propionate complexes New J. Chem., 2015, 39, 7688 |
7053767 | CIF | C109 H140 Cl2 N12 O16 | P -1 | 12.1987; 20.8765; 24.7757 70.119; 79.842; 73.692 | 5671.9 | Zhan, Junyan; Tian, Demei; Li, Haibing Synthesis of calix[4]crowns containing soft and hard ion binding sites via click chemistry New Journal of Chemistry, 2009, 33, 725 |
7059598 | CIF | C109 H99 Cl2 N6 O21 Sm3 | P 1 21/c 1 | 25.4366; 17.6782; 23.8657 90; 104.017; 90 | 10412.2 | Wang, Wen-Min; Gao, Yu; Yue, Rong-Xin; Qiao, Na; Wang, Dan-Tong; Shi, Ying; Zhang, Huan; Cui, Jian-Zhong Construction of a family of Ln3 clusters using multidentate Schiff base and β-diketonate ligands: fluorescence properties, magnetocaloric effect and slow magnetic relaxation New Journal of Chemistry, 2020, 44, 9230-9237 |
7058748 | CIF | C109.91 H79.82 Au4 Cl3.82 P4 | P 1 21/c 1 | 14.6199; 16.5507; 20.7234 90; 101.121; 90 | 4920.27 | Belyaev, Andrey; Kolesnikov, Ilya; Melnikov, Alexei S.; Gurzhiy, Vladislav V.; Tunik, Sergey P.; Koshevoy, Igor O. Solution versus solid-state dual emission of the Au(i)-alkynyl diphosphine complexes via modification of polyaromatic spacers New Journal of Chemistry, 2019, 43, 13741 |
7054254 | CIF | C11 H F13 N2 | P 1 21/n 1 | 9.3577; 5.1436; 27.2757 90; 99.507; 90 | 1294.81 | 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 |
7056617 | CIF | C11 H10 B Cl2 F2 N7 | P b c a | 9.7915; 10.7841; 28.665 90; 90; 90 | 3026.8 | Yousaf, Muhammad; Yutronkie, Nathan J.; Castañeda, Raúl; Klein, Jacob A.; Brusso, Jaclyn Boratriazines: inducing luminescence through boron incorporation into a terpy-type framework New J. Chem., 2017 |
7054664 | CIF | C11 H10 Br N3 O | P 1 21/n 1 | 13.5334; 12.3004; 28.098 90; 102.177; 90 | 4572.1 | Bustos, Carlos; Molins, Elies; Cárcamo, Juan-Guillermo; Aguilar, Marcelo N.; Sánchez, Christian; Moreno-Villoslada, Ignacio; Nishide, Hiroyuki; Mesías-Salazar, Angela; Zarate, Ximena; Schott, Eduardo New 3,4,5-trisubstituted isoxazole derivatives with potential biological properties New J. Chem., 2015, 39, 4295 |
7060422 | CIF | C11 H10 Cl0 N O | P -1 | 8.0403; 13.5577; 14.0775 68.65; 76.418; 81.653 | 1386.26 | Chen, Min; Geng, Chun-Wen; Han, Ling; Liu, Yu; Yu, Yong-Kai; Lu, Ai-Min; Yang, Chun-Long; Li, Guo-Hua Design, synthesis, crystal structure, and herbicidal activity of novel pyrrolidine-2,4-dione derivatives incorporating an alkyl ether pharmacophore with natural tetramic acids as lead compounds New Journal of Chemistry, 2021, 45, 5621-5630 |
7061259 | CIF | C11 H10 Cl0 N O S0.11 | P 1 21/c 1 | 11.8021; 14.8362; 11.906 90; 95.792; 90 | 2074.08 | Xing, Siyang; Wang, Chenyu; Gao, Tingxuan; Wang, Yuhan; Wang, Hongzheng; Wang, Hanfei; Wang, Kui; Zhu, Bolin Construction of 4-spiroannulated tetrahydroisoquinoline skeletons via a sequential ring opening of aziridines and Pictet–Spengler reaction New Journal of Chemistry, 2022, 46, 2553-2558 |
7057773 | CIF | C11 H10 Cl2 Co N2 Se | P -1 | 7.8194; 8.2508; 12.0455 94.298; 107.224; 115.874 | 648.75 | Cargnelutti, Roberta; Delgado, Cássia P.; Cervo, Rodrigo; Tirloni, Bárbara; Burrow, Robert A.; Lang, Ernesto S. Synthesis and structural chemistry of CoII, CuII, CuI and PdII complexes containing a flexible monoselenoether ligand New Journal of Chemistry, 2018, 42, 17185 |
7057777 | CIF | C11 H10 Cl2 Cu N2 Se | P -1 | 6.9883; 7.3034; 14.1926 77.705; 81.6484; 63.8415 | 634.17 | Cargnelutti, Roberta; Delgado, Cássia P.; Cervo, Rodrigo; Tirloni, Bárbara; Burrow, Robert A.; Lang, Ernesto S. Synthesis and structural chemistry of CoII, CuII, CuI and PdII complexes containing a flexible monoselenoether ligand New Journal of Chemistry, 2018, 42, 17185 |
7055029 | CIF | C11 H10 Cl2 Cu N2 Se2 | P b c a | 11.9328; 12.2111; 18.6534 90; 90; 90 | 2718 | Cargnelutti, Roberta; da Silva, Felipe Dornelles; Abram, Ulrich; Lang, Ernesto Schulz Metal complexes with bis(2-pyridyl)diselenoethers: structural chemistry and catalysis New J. Chem., 2015, 39, 7948 |
7061425 | CIF | C11 H10 Cl2 N O3 | P -1 | 7.3335; 8.027; 10.9917 95.693; 95.999; 114.74 | 577.07 | Li, Jiulong; Li, Chang; Ji, Xu; Sun, Qin; Li, Zhi; Liu, He; Zhou, Lina; Jing, Dingding; Gong, Junbo; Chen, Wei Combined virtual and experimental screening of multicomponent crystals of 2,4-dichlorophenoxyacetic acid New Journal of Chemistry, 2022, 46, 8708-8719 |
7055522 | CIF | C11 H10 Cu N4 S2 | P 1 21/c 1 | 10.8207; 12.6826; 9.658 90; 108.391; 90 | 1257.72 | Xu, Man-Man; Li, Yao; Zheng, Lin-Jie; Niu, Yun-Yin; Hou, Hong-Wei Three cation-templated Cu(i) self-assemblies: synthesis, structures, and photocatalytic properties New J. Chem., 2016, 40, 6086 |
7057778 | CIF | C11 H10 Cu2 I2 N2 Se | P 1 21 1 | 9.5828; 8.4187; 9.7002 90; 105.088; 90 | 755.58 | Cargnelutti, Roberta; Delgado, Cássia P.; Cervo, Rodrigo; Tirloni, Bárbara; Burrow, Robert A.; Lang, Ernesto S. Synthesis and structural chemistry of CoII, CuII, CuI and PdII complexes containing a flexible monoselenoether ligand New Journal of Chemistry, 2018, 42, 17185 |
7057069 | CIF | C11 H10 F N3 O6 | P 1 21/n 1 | 5.283; 17.757; 12.125 90; 95.183; 90 | 1132.8 | Nechipadappu, Sunil Kumar; Ramachandran, Jeeshma; Shivalingegowda, Naveen; Lokanath, Neratur Krishnappagowda; Trivedi, Darshak R. Synthesis of cocrystals/salts of flucytosine: Structure and stability New Journal of Chemistry, 2018, 42, 5433 |
7058828 | CIF | C11 H10 F N5 O9 | C 1 2 1 | 21.337; 5.4905; 12.445 90; 103.196; 90 | 1419.4 | Souza, Matheus S.; Diniz, Luan F.; Alvarez, Natalia; da Silva, Cecília C. P.; Ellena, Javier Supramolecular synthesis and characterization of crystalline solids obtained from the reaction of 5-fluorocytosine with nitro compounds New Journal of Chemistry, 2019, 43, 15924 |
7059940 | CIF | C11 H10 F3 N3 O3 | C 1 2/c 1 | 7.4429; 21.4011; 15.5986 90; 97.343; 90 | 2464.27 | Espitia Cogollo, E.; Piro, O. E.; Echeverría, G. A.; Tuttolomondo, M. E.; Pérez, H.; Jios, J. L.; Ulic, S. E. Hydrogen bonding interactions in fluorinated 1,2,3-triazole derivatives New Journal of Chemistry, 2020, 44, 16006-16019 |
7057164 | CIF | C11 H10 I N O2 | P 1 21/c 1 | 16.7005; 8.0961; 8.3096 90; 90.243; 90 | 1123.52 | Szell, Patrick M. J.; Dragon, Julien; Zablotny, Scott; Harrigan, Stephen R.; Gabidullin, Bulat; Bryce, David L. Mechanochemistry and cocrystallization of 3-iodoethynylbenzoic acid with nitrogen-containing heterocycles: concurrent halogen and hydrogen bonding New Journal of Chemistry, 2018, 42, 10493 |
7055076 | CIF | C11 H10 I2 O2 | P 1 21/n 1 | 12.8366; 7.0467; 14.279 90; 96.053; 90 | 1284.42 | Hettstedt, Christina; Mayer, Peter; Karaghiosoff, Konstantin Halogen bonding in the crystal structures of 1,2-diiodo alkenes New J. Chem., 2015, 39, 8522 |
7054514 | CIF | C11 H10 N2 O2 | P 1 21/c 1 | 15.6778; 3.9598; 17.4076 90; 108.928; 90 | 1022.24 | Song, Qingbao; Wang, Yongsheng; Hu, Chenchen; Zhang, Yujian; Sun, Jingwei; Wang, Kunyan; Zhang, Cheng Effect of stacking mode on the mechanofluorochromic properties of 3-aryl-2-cyano acrylamide derivatives New J. Chem., 2015, 39, 659 |
7054515 | CIF | C11 H10 N2 O2 | I 1 2/a 1 | 13.7381; 8.877; 17.564 90; 103.368; 90 | 2083.9 | Song, Qingbao; Wang, Yongsheng; Hu, Chenchen; Zhang, Yujian; Sun, Jingwei; Wang, Kunyan; Zhang, Cheng Effect of stacking mode on the mechanofluorochromic properties of 3-aryl-2-cyano acrylamide derivatives New J. Chem., 2015, 39, 659 |
7054516 | CIF | C11 H10 N2 O2 | P 1 21/c 1 | 3.92; 10.792; 23.124 90; 93.463; 90 | 976.5 | Song, Qingbao; Wang, Yongsheng; Hu, Chenchen; Zhang, Yujian; Sun, Jingwei; Wang, Kunyan; Zhang, Cheng Effect of stacking mode on the mechanofluorochromic properties of 3-aryl-2-cyano acrylamide derivatives New J. Chem., 2015, 39, 659 |
7056097 | CIF | C11 H10 N2 O4 | P -1 | 9.1088; 9.372; 13.9495 97.358; 92.518; 118.232 | 1033.06 | ., Mayank; Singh, Amanpreet; Raj, Pushap; Kaur, Randeep; Singh, Ajnesh; Kaur, Navneet; Singh, Narinder Zwitterionic Liquid (ZIL) Coated CuO as an Efficient Catalyst for the Green Syntheses of Bis-Coumarins derivatives via One-Pot Multi-component Reactions Using Mechanochemistry New J. Chem., 2017 |
7061605 | CIF | C11 H10 N2 O4 | P 1 21/n 1 | 12.8617; 6.1503; 13.2247 90; 99.683; 90 | 1031.21 | Fu, Peng; Yan, Qing; Wang, Sheng; Wu, Hanlun; Cao, Derong A visible-light-gated donor–acceptor Stenhouse adduct chemosensor: synthesis, photochromism and naked-eye colorimetric/fluorometric sensing of Al3+ and Zn2+ New Journal of Chemistry, 2022, 46, 12600-12608 |
7054665 | CIF | C11 H10 N4 O3 | C 1 2/c 1 | 11.765; 11.314; 17.774 90; 95.75; 90 | 2354 | Bustos, Carlos; Molins, Elies; Cárcamo, Juan-Guillermo; Aguilar, Marcelo N.; Sánchez, Christian; Moreno-Villoslada, Ignacio; Nishide, Hiroyuki; Mesías-Salazar, Angela; Zarate, Ximena; Schott, Eduardo New 3,4,5-trisubstituted isoxazole derivatives with potential biological properties New J. Chem., 2015, 39, 4295 |
7056232 | CIF | C11 H10 N6 O Se | P 1 21/n 1 | 6.246; 23.899; 8.301 90; 97.582; 90 | 1228.3 | Leal, Julliano Guerin; Sauer, André Carpes; Mayer, João Cândido Pilar; Stefanello, Sílvio Terra; Gonçalves, Debora Farina; Soares, FAA; Iglesias, Bernardo Almeida; Back, Davi Fernando; Rodrigues, Oscar E. D.; Dornelles, Luciano Synthesis and electrochemical and antioxidant properties of chalcogenocyanateoxadiazole and 5-heteroarylchalcogenomethyl-1H-tetrazole derivatives New J. Chem., 2017 |
7061839 | CIF | C11 H10 N6 O2 | P 1 21/c 1 | 14.3117; 10.6121; 15.8829 90; 113.323; 90 | 2215.1 | Castro, Jesús; Ferraro, Valentina; Bortoluzzi, Marco Visible-emitting Cu(i) complexes with N-functionalized benzotriazole-based ligands New Journal of Chemistry, 2022, 46, 18938-18951 |
7055148 | CIF | C11 H10 O | C 1 2/c 1 | 15.0282; 7.542; 14.8454 90; 91.901; 90 | 1681.69 | Honzíčková, Iva; Vinklárek, Jaromír; Romão, Carlos C.; Růžičková, Zdeňka; Honzíček, Jan Novel indenyl ligands bearing electron-withdrawing functional groups New J. Chem., 2016, 40, 245 |
7056234 | CIF | C11 H10 O S | I 1 2/m 1 | 11.0492; 6.9453; 13.528 90; 107.219; 90 | 991.61 | Delgado Espinosa, Zuly; Saeed, Aamer; Mahmood, Shamsul; Echeverría, Gustavo A.; Piro, Oscar E.; Erben, Mauricio Federico Federico The Effect of Chalcogen Substitution on the Structure and Spectroscopy of 4,7-Dimethyl-2H-chromen-2-one/thione Analogues New J. Chem., 2017 |
7060790 | CIF | C11 H11 Br2 Co N3 Se | P 1 21/n 1 | 8.3309; 12.1666; 14.2649 90; 93.019; 90 | 1443.87 | Cervo, Rodrigo; Lopes, Thaísa R. R.; de Vasconcelos, Adriana R.; Cargnelutti, Juliana F.; Schumacher, Ricardo F.; Tirloni, Bárbara; dos Santos, Sailer S.; Abram, Ulrich; Lang, Ernesto S.; Cargnelutti, Roberta Coordination compounds containing 2-pyridylselenium ligands: synthesis, structural characterization, and antibacterial evaluation New Journal of Chemistry, 2021, 45, 12863-12870 |
7060788 | CIF | C11 H11 Cl2 Co N3 Se | P -1 | 7.691; 7.7691; 12.7167 97.994; 91.522; 112.289 | 693.63 | Cervo, Rodrigo; Lopes, Thaísa R. R.; de Vasconcelos, Adriana R.; Cargnelutti, Juliana F.; Schumacher, Ricardo F.; Tirloni, Bárbara; dos Santos, Sailer S.; Abram, Ulrich; Lang, Ernesto S.; Cargnelutti, Roberta Coordination compounds containing 2-pyridylselenium ligands: synthesis, structural characterization, and antibacterial evaluation New Journal of Chemistry, 2021, 45, 12863-12870 |
7060789 | CIF | C11 H11 Cl2 Cu N3 Se | P n a 21 | 13.8873; 12.4918; 7.967 90; 90; 90 | 1382.09 | Cervo, Rodrigo; Lopes, Thaísa R. R.; de Vasconcelos, Adriana R.; Cargnelutti, Juliana F.; Schumacher, Ricardo F.; Tirloni, Bárbara; dos Santos, Sailer S.; Abram, Ulrich; Lang, Ernesto S.; Cargnelutti, Roberta Coordination compounds containing 2-pyridylselenium ligands: synthesis, structural characterization, and antibacterial evaluation New Journal of Chemistry, 2021, 45, 12863-12870 |
7060791 | CIF | C11 H11 Cl2 N3 Se Zn | P -1 | 7.6875; 7.775; 12.7025 98.029; 91.212; 112.392 | 692.81 | Cervo, Rodrigo; Lopes, Thaísa R. R.; de Vasconcelos, Adriana R.; Cargnelutti, Juliana F.; Schumacher, Ricardo F.; Tirloni, Bárbara; dos Santos, Sailer S.; Abram, Ulrich; Lang, Ernesto S.; Cargnelutti, Roberta Coordination compounds containing 2-pyridylselenium ligands: synthesis, structural characterization, and antibacterial evaluation New Journal of Chemistry, 2021, 45, 12863-12870 |
7051450 | CIF | C11 H11 Cl3 Fe N3 | P 1 21/n 1 | 11.257; 8.671; 14.644 90; 107.33; 90 | 1364.5 | Michael Renz; Catherine Hemmert; Heinz Gornitzka; Bernard Meunier Influence of the anion of FeIII salts on the product distribution in the oxidative degradation of a tetrapyridyl ligand New Journal of Chemistry, 1999 |
7057592 | CIF | C11 H11 F N4 O3 | P 1 21/c 1 | 4.8695; 24.4911; 9.8792 90; 97.567; 90 | 1167.93 | Souza, Matheus S.; Diniz, Luan F.; Vogt, Lautaro; Carvalho, Paulo S.; D’vries, Richard F.; Ellena, Javier Avoiding irreversible 5-fluorocytosine hydration via supramolecular synthesis of pharmaceutical cocrystals New Journal of Chemistry, 2018, 42, 14994 |
7052214 | CIF | C11 H11 Fe2 N O7 S2 | P -1 | 7.4291; 9.8933; 11.8779 73.116; 78.757; 86.088 | 819.28 | Capon, Jean-François; Ezzaher, Salah; Gloaguen, Frédéric; Pétillon, François Y.; Schollhammer, Philippe; Talarmin, Jean; Davin, Thomas J.; McGrady, John E.; Muir, Kenneth W. Electrochemical and theoretical investigations of the reduction of [Fe2(CO)5L{µ-SCH2XCH2S}] complexes related to [FeFe] hydrogenase New Journal of Chemistry, 2007, 31, 2052 |
7062226 | CIF | C11 H11 I N2 O | R -3 :H | 27.1958; 27.1958; 7.8944 90; 90; 120 | 5056.5 | Wilson, Laura M. E.; Rissanen, Kari; Ward, Jas S. Iodination of antipyrine with [N–I–N]+ and carbonyl hypoiodite iodine(i) complexes New Journal of Chemistry, 2023, 47, 2978-2982 |
7063186 | CIF | C11 H11 N O | C 1 2/c 1 | 13.5293; 7.3263; 19.0986 90; 99.741; 90 | 1865.75 | Altia, Minakshi; Anbarasan, Pazhamalai α-Hydroxydimethylacetal/ketal as α-hydroxycarbonyl equivalent in interrupted Heyns/Amadori rearrangement: Regioselective synthesis of substituted C2- and C3-acylindoles New Journal of Chemistry, 2024 |
7050364 | CIF | C11 H11 N O2 | P -1 | 7.8375; 10.1625; 12.272 82.819; 83.055; 82.805 | 956.7 | J. Narasimha Moorthy; R.Natarajan; Prasenjit Mal; P.Venugopalan First example of a helical nanotube sustained by weak C-H∙∙∙O/N hydrogen bonds: Remarkable self-assembly of an o-anisaldehyde New J.Chem.(Nouv.J.Chim.), 2004 |
7057486 | CIF | C11 H11 N O3 | P -1 | 8.0084; 8.1626; 8.5962 63.646; 69.49; 73.138 | 465.51 | Kumar, K. Shiva; Ramulu, Meesa Siddi; Kumar, N. Praveen Unexpected C‒N bond formation via Smiles rearrangement: one pot synthesis of N-arylated coumarin/pyran derivatives New Journal of Chemistry, 2018, 42, 11276 |
7063078 | CIF | C11 H11 N O4 S | P 1 21/n 1 | 7.6259; 22.2673; 12.9983 90; 92.158; 90 | 2205.7 | Lu, Zujia; Yang, Guangzao; Luo, Huaxin; Gao, Minjie; Irfan, Majeed; Wang, Fei; Zeng, Zhuo An efficient and straightforward approach for accessing sulfonamide/N-sulfonyl succinic esters via potassium fluoride-promoted C–N cleavage of N-sulfonyl succinimide New Journal of Chemistry, 2024, 48, 6378-6385 |
7051537 | CIF | C11 H11 N O5 S | P 1 21/c 1 | 9.847; 11.791; 11.014 90; 110.58; 90 | 1197.2 | Stefanowicz, Piotr; Jaremko, Łukasz; Jaremko, Mariusz; Lis, Tadeusz Crystal-state studies on p-toluenesulfonates of N-oxyimides—a possible structural basis of serine proteases inhibition New Journal of Chemistry, 2006, 30, 258 |
7050128 | CIF | C11 H11 N3 | C 1 2 1 | 18.373; 5.489; 11.369 90; 124.22; 90 | 948.1 | Munro, Orde Q.; Strydom, Sandra D.; Grimmer, Craig D. Complementary hydrogen bonding in a new tridentate Schiff base ligand: X-ray, DFT and solution NMR studiesElectronic supplementary information (ESI) available: unit cell packing diagram for 3 (Fig. S1) and 1H NMR spectra of 3 as a function of the concentration of added H2O in CDCl3 solution (Fig. S2). See http://www.rsc.org/suppdata/nj/b3/b305946d/ New Journal of Chemistry, 2004, 28, 34 |
7051488 | CIF | C11 H11 N3 O | P b c a | 7.565; 14.423; 19.793 90; 90; 90 | 2159.6 | New Journal of Chemistry, 1999 |
7052217 | CIF | C11 H11 N3 O | P 1 21/c 1 | 21.66; 4.7544; 9.9321 90; 93.912; 90 | 1020.4 | Aakeröy, Christer B.; Scott, Benjamin M. T.; Desper, John How robust is the hydrogen-bonded amide ‘ladder’ motif? New Journal of Chemistry, 2007, 31, 2044 |
7052220 | CIF | C11 H11 N3 O | P -1 | 7.7873; 8.113; 8.84 77.6614; 74.4604; 68.3976 | 496.14 | Aakeröy, Christer B.; Scott, Benjamin M. T.; Desper, John How robust is the hydrogen-bonded amide ‘ladder’ motif? New Journal of Chemistry, 2007, 31, 2044 |
7059531 | CIF | C11 H11 N3 O S2 | P 21 21 21 | 4.5172; 13.5286; 19.8833 90; 90; 90 | 1215.1 | Yekke-ghasemi, Zahra; Ramezani, Mohammad; Mague, Joel T.; Takjoo, Reza Synthesis, characterization and bioactivity studies of new dithiocarbazate complexes New Journal of Chemistry, 2020, 44, 8878-8889 |
7053051 | CIF | C11 H11 N3 O3 | P 1 21/n 1 | 15.8072; 4.92528; 16.3792 90; 116.696; 90 | 1139.27 | Belmar, Julio; Quezada, José; Jiménez, Claudio A.; Díaz-Gallifa, Pau; Pasán, Jorge; Ruiz-Pérez, Catalina Synthesis, crystal structures and tautomerism in novel oximes based on hydroxyalkylpyrazolones New Journal of Chemistry, 2013, 37, 2002 |
7052836 | CIF | C11 H11 N5 O7 | C 1 c 1 | 6.0755; 15.089; 14.771 90; 90.949; 90 | 1353.9 | Smiglak, Marcin; Hines, C. Corey; Reichert, W. Matthew; Vincek, Adam S.; Katritzky, Alan R.; Thrasher, Joseph S.; Sun, Luyi; McCrary, Parker D.; Beasley, Preston A.; Kelley, Steven P.; Rogers, Robin D. Synthesis, limitations, and thermal properties of energetically-substituted, protonated imidazolium picrate and nitrate salts and further comparison with their methylated analogs New Journal of Chemistry, 2012, 36, 702 |
7052838 | CIF | C11 H11 N5 O7 | P -1 | 7.2105; 9.615; 10.265 78.308; 82.099; 85.773 | 689.5 | Smiglak, Marcin; Hines, C. Corey; Reichert, W. Matthew; Vincek, Adam S.; Katritzky, Alan R.; Thrasher, Joseph S.; Sun, Luyi; McCrary, Parker D.; Beasley, Preston A.; Kelley, Steven P.; Rogers, Robin D. Synthesis, limitations, and thermal properties of energetically-substituted, protonated imidazolium picrate and nitrate salts and further comparison with their methylated analogs New Journal of Chemistry, 2012, 36, 702 |
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