Crystallography Open Database
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Searching journal of publication like 'CrystEngComm' volume of publication is 26
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1571179 | CIF | C53 H43 Fe O13 S32 | C 1 2/c 1 | 10.2478; 19.9069; 35.264 90; 94.106; 90 | 7175.5 | Blundell, Toby J.; Rusbridge, Elizabeth K.; Pemberton, Rebecca E.; Brannan, Michael J.; Morritt, Alexander L.; Ogar, Joseph O.; Wallis, John D.; Akutsu, Hiroki; Nakazawa, Yasuhiro; Imajo, Shusaku; Martin, Lee Introduction of new guest molecules into BEDT-TTF radical-cation salts with tris(oxalato)ferrate CrystEngComm, 2024, 26, 1962-1975 |
| 1571180 | CIF | C52 H39 Fe O14 S32 | C 1 2/c 1 | 10.3279; 20.0206; 35.3409 90; 92.91; 90 | 7298 | Blundell, Toby J.; Rusbridge, Elizabeth K.; Pemberton, Rebecca E.; Brannan, Michael J.; Morritt, Alexander L.; Ogar, Joseph O.; Wallis, John D.; Akutsu, Hiroki; Nakazawa, Yasuhiro; Imajo, Shusaku; Martin, Lee Introduction of new guest molecules into BEDT-TTF radical-cation salts with tris(oxalato)ferrate CrystEngComm, 2024, 26, 1962-1975 |
| 1571181 | CIF | C53 H41 Fe O14 S32 | P -1 | 10.2331; 11.1922; 35.2191 89.485; 86.524; 62.861 | 3582.2 | Blundell, Toby J.; Rusbridge, Elizabeth K.; Pemberton, Rebecca E.; Brannan, Michael J.; Morritt, Alexander L.; Ogar, Joseph O.; Wallis, John D.; Akutsu, Hiroki; Nakazawa, Yasuhiro; Imajo, Shusaku; Martin, Lee Introduction of new guest molecules into BEDT-TTF radical-cation salts with tris(oxalato)ferrate CrystEngComm, 2024, 26, 1962-1975 |
| 1571182 | CIF | C56 H44 Fe O14 S40 | P -1 | 11.1233; 11.5487; 35.1801 89.381; 85.771; 69.934 | 4232.83 | Blundell, Toby J.; Rusbridge, Elizabeth K.; Pemberton, Rebecca E.; Brannan, Michael J.; Morritt, Alexander L.; Ogar, Joseph O.; Wallis, John D.; Akutsu, Hiroki; Nakazawa, Yasuhiro; Imajo, Shusaku; Martin, Lee Introduction of new guest molecules into BEDT-TTF radical-cation salts with tris(oxalato)ferrate CrystEngComm, 2024, 26, 1962-1975 |
| 1571183 | CIF | C50 H37 Fe O12 S32 | P 1 2/n 1 | 24.9368; 19.4844; 31.8267 90; 108.849; 90 | 14634.6 | Blundell, Toby J.; Rusbridge, Elizabeth K.; Pemberton, Rebecca E.; Brannan, Michael J.; Morritt, Alexander L.; Ogar, Joseph O.; Wallis, John D.; Akutsu, Hiroki; Nakazawa, Yasuhiro; Imajo, Shusaku; Martin, Lee Introduction of new guest molecules into BEDT-TTF radical-cation salts with tris(oxalato)ferrate CrystEngComm, 2024, 26, 1962-1975 |
| 7247746 | CIF | C42 H48 Mn4 N4 O20 | P -1 | 10.5827; 11.1323; 12.6983 104.061; 113.978; 90.275 | 1316.85 | Kumar, Jayasree; Tarannum, Ibtesham; Zheng, Yan-Zhen; Singh, Saurabh Kumar; Mondal, Kartik Chandra Assembly of MnIII ions into di-, tetra-, deca-nuclear coordination complexes, zero- to three-dimensional molecular frameworks: molecular spin flop to and short-range bulk magnetic spin flop ordering CrystEngComm, 2024, 26, 80-99 |
| 7247747 | CIF | C30 H32 Mn2 N6 O8 | P -1 | 7.8214; 9.9952; 10.4841 94.868; 105.897; 94.543 | 780.92 | Kumar, Jayasree; Tarannum, Ibtesham; Zheng, Yan-Zhen; Singh, Saurabh Kumar; Mondal, Kartik Chandra Assembly of MnIII ions into di-, tetra-, deca-nuclear coordination complexes, zero- to three-dimensional molecular frameworks: molecular spin flop to and short-range bulk magnetic spin flop ordering CrystEngComm, 2024, 26, 80-99 |
| 7247748 | CIF | C30 H28 Mn2 N6 O8 | P -1 | 10.063; 12.143; 15.195 68.52; 73.73; 71.1 | 1607 | Kumar, Jayasree; Tarannum, Ibtesham; Zheng, Yan-Zhen; Singh, Saurabh Kumar; Mondal, Kartik Chandra Assembly of MnIII ions into di-, tetra-, deca-nuclear coordination complexes, zero- to three-dimensional molecular frameworks: molecular spin flop to and short-range bulk magnetic spin flop ordering CrystEngComm, 2024, 26, 80-99 |
| 7247749 | CIF | C69 H60 Mn5 N12 O21 S5 | P -1 | 9.888; 20.717; 21.011 71.075; 77.324; 80.532 | 3952 | Kumar, Jayasree; Tarannum, Ibtesham; Zheng, Yan-Zhen; Singh, Saurabh Kumar; Mondal, Kartik Chandra Assembly of MnIII ions into di-, tetra-, deca-nuclear coordination complexes, zero- to three-dimensional molecular frameworks: molecular spin flop to and short-range bulk magnetic spin flop ordering CrystEngComm, 2024, 26, 80-99 |
| 7247754 | CIF | C3 H5 N5 O2 | P b c a | 9.7958; 7.7989; 14.7319 90; 90; 90 | 1125.47 | Zhang, Lingfeng; Wang, Yu; Wang, Yefeng; Liu, Shuai; Zhang, Na; Yang, Mingmin; Ma, Haixia; Guo, Zhaoqi N-Methylene-C bridged tetrazole and 1,2,4-triazole energetic salts as promising primary explosives CrystEngComm, 2024, 26, 143-152 |
| 7247755 | CIF | C4 H6 K2 N11 O6 | P -1 | 4.0899; 8.238; 20.69 96.88; 90.38; 95.16 | 689.2 | Zhang, Lingfeng; Wang, Yu; Wang, Yefeng; Liu, Shuai; Zhang, Na; Yang, Mingmin; Ma, Haixia; Guo, Zhaoqi N-Methylene-C bridged tetrazole and 1,2,4-triazole energetic salts as promising primary explosives CrystEngComm, 2024, 26, 143-152 |
| 7247756 | CIF | C4 H8 N10 | P 1 21/c 1 | 9.0488; 13.078; 6.7239 90; 101.968; 90 | 778.4 | Zhang, Lingfeng; Wang, Yu; Wang, Yefeng; Liu, Shuai; Zhang, Na; Yang, Mingmin; Ma, Haixia; Guo, Zhaoqi N-Methylene-C bridged tetrazole and 1,2,4-triazole energetic salts as promising primary explosives CrystEngComm, 2024, 26, 143-152 |
| 7247757 | CIF | C4 H11 N12 O7 | P 1 21/c 1 | 3.8946; 14.07; 23.813 90; 92.162; 90 | 1304 | Zhang, Lingfeng; Wang, Yu; Wang, Yefeng; Liu, Shuai; Zhang, Na; Yang, Mingmin; Ma, Haixia; Guo, Zhaoqi N-Methylene-C bridged tetrazole and 1,2,4-triazole energetic salts as promising primary explosives CrystEngComm, 2024, 26, 143-152 |
| 7247790 | CIF | C15 H12 O2 | P b c a | 8.6333; 10.6401; 24.273 90; 90; 90 | 2229.7 | Liu, Yumin; Gong, Junbo; Yan, Dongpeng; Wang, Jingkang Insight into polymorphism in weakly polar systems using favorable connection motifs CrystEngComm, 2024, 26, 153-159 |
| 7247791 | CIF | C15 H12 O2 | P 1 21/c 1 | 12.5547; 11.7675; 7.7848 90; 103.444; 90 | 1118.59 | Liu, Yumin; Gong, Junbo; Yan, Dongpeng; Wang, Jingkang Insight into polymorphism in weakly polar systems using favorable connection motifs CrystEngComm, 2024, 26, 153-159 |
| 7247796 | CIF | C54 H36 Co4 N4 O25 | P -1 | 9.366; 10.5136; 15.0815 107.389; 91.634; 107.736 | 1338.12 | Yang, Yuan-Yu; Xue, Jian-Hua; Yang, Dong-Dong; Zhang, Li-Yang; Ma, Qi; Zhao, Xuan Effects of solvents and metal ions on the synthesis, structural diversity and magnetic properties of the 5′-nitro-[1,1′:3′,1′′-terphenyl]-3,3′′,5,5′′-tetracarboxylic acid ligand and a highly sensitive sensor for Fe3+ CrystEngComm, 2024, 26, 170-179 |
| 7247797 | CIF | C32 H27 N3 O15 Zn2 | C 1 2/c 1 | 18.995; 11.667; 16.273 90; 113.608; 90 | 3304.5 | Yang, Yuan-Yu; Xue, Jian-Hua; Yang, Dong-Dong; Zhang, Li-Yang; Ma, Qi; Zhao, Xuan Effects of solvents and metal ions on the synthesis, structural diversity and magnetic properties of the 5′-nitro-[1,1′:3′,1′′-terphenyl]-3,3′′,5,5′′-tetracarboxylic acid ligand and a highly sensitive sensor for Fe3+ CrystEngComm, 2024, 26, 170-179 |
| 7247798 | CIF | C32 H27 Co2 N3 O15 | C 1 2/c 1 | 19.1756; 11.7383; 15.5273 90; 111.057; 90 | 3261.6 | Yang, Yuan-Yu; Xue, Jian-Hua; Yang, Dong-Dong; Zhang, Li-Yang; Ma, Qi; Zhao, Xuan Effects of solvents and metal ions on the synthesis, structural diversity and magnetic properties of the 5′-nitro-[1,1′:3′,1′′-terphenyl]-3,3′′,5,5′′-tetracarboxylic acid ligand and a highly sensitive sensor for Fe3+ CrystEngComm, 2024, 26, 170-179 |
| 7247799 | CIF | C52 H59 N7 Ni2 O23 | F d d d :2 | 19.5933; 22.7256; 52.888 90; 90; 90 | 23549 | Yang, Yuan-Yu; Xue, Jian-Hua; Yang, Dong-Dong; Zhang, Li-Yang; Ma, Qi; Zhao, Xuan Effects of solvents and metal ions on the synthesis, structural diversity and magnetic properties of the 5′-nitro-[1,1′:3′,1′′-terphenyl]-3,3′′,5,5′′-tetracarboxylic acid ligand and a highly sensitive sensor for Fe3+ CrystEngComm, 2024, 26, 170-179 |
| 7247803 | CIF | C4 H16 Bi Cl5 N2 | C m c e | 7.564; 21.9862; 17.8275 90; 90; 90 | 2964.78 | Pradhan, Abinash; Sahoo, Sanand; Samal, Saroj L. (C2H5NH3)2BiCl5−xBrx perovskites containing 1D chains: effect of Br substitution on their structural and optical properties CrystEngComm, 2024, 26, 312-323 |
| 7247804 | CIF | C4 H16 Bi Br2.27 Cl2.73 N2 | C m c e | 7.6954; 22.2151; 17.9473 90; 90; 90 | 3068.16 | Pradhan, Abinash; Sahoo, Sanand; Samal, Saroj L. (C2H5NH3)2BiCl5−xBrx perovskites containing 1D chains: effect of Br substitution on their structural and optical properties CrystEngComm, 2024, 26, 312-323 |
| 7247805 | CIF | C4 H16 Bi Br3.13 Cl1.87 N2 | C m c e | 7.767; 22.3242; 18.0376 90; 90; 90 | 3127.58 | Pradhan, Abinash; Sahoo, Sanand; Samal, Saroj L. (C2H5NH3)2BiCl5−xBrx perovskites containing 1D chains: effect of Br substitution on their structural and optical properties CrystEngComm, 2024, 26, 312-323 |
| 7247806 | CIF | C4 H16 Bi Br5 N2 | C m c e | 7.894; 22.4137; 18.2284 90; 90; 90 | 3225.22 | Pradhan, Abinash; Sahoo, Sanand; Samal, Saroj L. (C2H5NH3)2BiCl5−xBrx perovskites containing 1D chains: effect of Br substitution on their structural and optical properties CrystEngComm, 2024, 26, 312-323 |
| 7247807 | CIF | C4 H16 Bi Br1.18 Cl3.82 N2 | C m c e | 7.6366; 22.1176; 17.8909 90; 90; 90 | 3021.83 | Pradhan, Abinash; Sahoo, Sanand; Samal, Saroj L. (C2H5NH3)2BiCl5−xBrx perovskites containing 1D chains: effect of Br substitution on their structural and optical properties CrystEngComm, 2024, 26, 312-323 |
| 7247808 | CIF | C4 H16 Bi Br5 N2 | A e a 2 | 18.2458; 22.4324; 7.8919 90; 90; 90 | 3230.13 | Pradhan, Abinash; Sahoo, Sanand; Samal, Saroj L. (C2H5NH3)2BiCl5−xBrx perovskites containing 1D chains: effect of Br substitution on their structural and optical properties CrystEngComm, 2024, 26, 312-323 |
| 7247809 | CIF | C4 H16 Bi Cl5 N2 | A e a 2 | 17.5689; 21.6639; 7.487 90; 90; 90 | 2849.6 | Pradhan, Abinash; Sahoo, Sanand; Samal, Saroj L. (C2H5NH3)2BiCl5−xBrx perovskites containing 1D chains: effect of Br substitution on their structural and optical properties CrystEngComm, 2024, 26, 312-323 |
| 7247810 | CIF | C4 H16 Bi Br2.12 Cl2.88 N2 | A e a 2 | 17.7119; 22.0532; 7.5527 90; 90; 90 | 2950.12 | Pradhan, Abinash; Sahoo, Sanand; Samal, Saroj L. (C2H5NH3)2BiCl5−xBrx perovskites containing 1D chains: effect of Br substitution on their structural and optical properties CrystEngComm, 2024, 26, 312-323 |
| 7247811 | CIF | C4 H16 Bi Br1.15 Cl3.85 N2 | A e a 2 | 17.6291; 21.9787; 7.512 90; 90; 90 | 2910.63 | Pradhan, Abinash; Sahoo, Sanand; Samal, Saroj L. (C2H5NH3)2BiCl5−xBrx perovskites containing 1D chains: effect of Br substitution on their structural and optical properties CrystEngComm, 2024, 26, 312-323 |
| 7247812 | CIF | C4 H16 Bi Cl5 N2 | P b c a | 17.5665; 7.4508; 22.164 90; 90; 90 | 2900.92 | Pradhan, Abinash; Sahoo, Sanand; Samal, Saroj L. (C2H5NH3)2BiCl5−xBrx perovskites containing 1D chains: effect of Br substitution on their structural and optical properties CrystEngComm, 2024, 26, 312-323 |
| 7247813 | CIF | C35 H59 Mn3.5 Mo12 N10 O71 P8 | P -1 | 14.7317; 15.1925; 20.7026 97.426; 105.699; 93.95 | 4397 | Liu, Xiaodong; Xu, Na; Liu, Xiaohui; Guo, Yanyan; Wang, Xiuli A new {P4Mo6}-based complex as a highly efficient heterogeneous catalyst for the oxidation of alkylbenzenes under mild conditions CrystEngComm, 2024, 26, 364-369 |
| 7247822 | CIF | C19 H29 Co N4 O13 P | P 1 21 1 | 7.9718; 14.0812; 11.5373 90; 95.204; 90 | 1289.75 | Zhang, Menglei; Li, Zhongkui; Zhu, Yanhong; Yan, Li; Zhong, Xue; Zhang, Yijie; Li, Ziyao; Bai, Yixiang; Li, Hui Mimic uracil–uracil base pairing: self-assembly and single crystal structure CrystEngComm, 2024, 26, 261-267 |
| 7247823 | CIF | C33 H63 Co2 N9 O32 P2 | P 1 | 6.7824; 13.8721; 15.7504 68.453; 89.86; 80.963 | 1358.8 | Zhang, Menglei; Li, Zhongkui; Zhu, Yanhong; Yan, Li; Zhong, Xue; Zhang, Yijie; Li, Ziyao; Bai, Yixiang; Li, Hui Mimic uracil–uracil base pairing: self-assembly and single crystal structure CrystEngComm, 2024, 26, 261-267 |
| 7247824 | CIF | C30 H50 Co2 N8 O27 P2 | P 1 | 6.9314; 13.624; 15.739 115.138; 93.184; 96.631 | 1327.4 | Zhang, Menglei; Li, Zhongkui; Zhu, Yanhong; Yan, Li; Zhong, Xue; Zhang, Yijie; Li, Ziyao; Bai, Yixiang; Li, Hui Mimic uracil–uracil base pairing: self-assembly and single crystal structure CrystEngComm, 2024, 26, 261-267 |
| 7247825 | CIF | C58 H82 Co2 N20 O30 P2 | P 1 21 1 | 11.7; 31.93; 11.774 90; 106.376; 90 | 4220.1 | Zhang, Menglei; Li, Zhongkui; Zhu, Yanhong; Yan, Li; Zhong, Xue; Zhang, Yijie; Li, Ziyao; Bai, Yixiang; Li, Hui Mimic uracil–uracil base pairing: self-assembly and single crystal structure CrystEngComm, 2024, 26, 261-267 |
| 7247826 | CIF | C27 H35 Cd N8 O14 P | C 2 2 21 | 10.7744; 25.5061; 31.6431 90; 90; 90 | 8695.9 | Zhang, Menglei; Li, Zhongkui; Zhu, Yanhong; Yan, Li; Zhong, Xue; Zhang, Yijie; Li, Ziyao; Bai, Yixiang; Li, Hui Mimic uracil–uracil base pairing: self-assembly and single crystal structure CrystEngComm, 2024, 26, 261-267 |
| 7247833 | CIF | C27 H18 Cu N4 O9 | P 1 21/n 1 | 5.1004; 20.907; 21.437 90; 94.484; 90 | 2278.9 | Duan, Wen-Long; Yan, Ming-Yue; Yan, Feng; Luan, Jian Fabrication of two 5-R-isophthalic acid-modulated Cu-based coordination polymers as urease inhibitors CrystEngComm, 2024, 26, 324-333 |
| 7247834 | CIF | C34 H24 Cu2 N6 O17 | P n m a | 13.3687; 19.6383; 12.8093 90; 90; 90 | 3362.9 | Duan, Wen-Long; Yan, Ming-Yue; Yan, Feng; Luan, Jian Fabrication of two 5-R-isophthalic acid-modulated Cu-based coordination polymers as urease inhibitors CrystEngComm, 2024, 26, 324-333 |
| 7247836 | CIF | C12 H16 N3 O3 | P 1 21/c 1 | 19.0668; 8.1886; 8.0487 90; 91.561; 90 | 1256.18 | Scheepers, Matthew C.; Lemmerer, Andreas The design of a series of cocrystals featuring dicarboxylic acid with a modified isoniazid derivative CrystEngComm, 2024, 26, 268-276 |
| 7247837 | CIF | C25 H34 N6 O6 | C 1 2/c 1 | 47.13; 5.0755; 23.567 90; 111.352; 90 | 5250.5 | Scheepers, Matthew C.; Lemmerer, Andreas The design of a series of cocrystals featuring dicarboxylic acid with a modified isoniazid derivative CrystEngComm, 2024, 26, 268-276 |
| 7247838 | CIF | C13 H18 N3 O3 | P 1 21/c 1 | 19.888; 8.2744; 8.3942 90; 96.316; 90 | 1373 | Scheepers, Matthew C.; Lemmerer, Andreas The design of a series of cocrystals featuring dicarboxylic acid with a modified isoniazid derivative CrystEngComm, 2024, 26, 268-276 |
| 7247839 | CIF | C28 H40 N6 O6 | P -1 | 7.9554; 13.7715; 14.6005 72.874; 75.014; 84.453 | 1476.32 | Scheepers, Matthew C.; Lemmerer, Andreas The design of a series of cocrystals featuring dicarboxylic acid with a modified isoniazid derivative CrystEngComm, 2024, 26, 268-276 |
| 7247840 | CIF | C13.5 H19 N3 O3 | C 1 2/c 1 | 22.0145; 16.7461; 7.9045 90; 100.476; 90 | 2865.5 | Scheepers, Matthew C.; Lemmerer, Andreas The design of a series of cocrystals featuring dicarboxylic acid with a modified isoniazid derivative CrystEngComm, 2024, 26, 268-276 |
| 7247841 | CIF | C19 H15 N3 O | P b c a | 12.4347; 7.204; 33.7027 90; 90; 90 | 3019.1 | Han, Chuchu; Yang, Jing; Zhang, Xin; Li, Aisen; Peng, Jiang Dual control of passive light output direction by light and mechanical forces in elastic crystals CrystEngComm, 2024, 26, 203-208 |
| 7247844 | CIF | C32 H22 Co2 N4 O9 S6 | C 2 2 21 | 16.832; 14.5894; 23.725 90; 90; 90 | 5826.1 | Duan, Chun-Pu; Ni, Ya-Lu; Yang, Xu-Dong; Huang, Jing-Yu; Shen, Yong-Hui; Gu, Xun-Gang; Ni, Gang; Ma, Miao-Lian; Li, Juan; Qin, Ling Electrocatalytic hydrogen evolution of MOF-derived materials based on conjugated or unconjugated ligands CrystEngComm, 2024, 26, 370-380 |
| 7247845 | CIF | C36 H20 Co2 N8 O8 S4 | P 1 21/c 1 | 15.156; 18.378; 15.9626 90; 91.834; 90 | 4443.9 | Duan, Chun-Pu; Ni, Ya-Lu; Yang, Xu-Dong; Huang, Jing-Yu; Shen, Yong-Hui; Gu, Xun-Gang; Ni, Gang; Ma, Miao-Lian; Li, Juan; Qin, Ling Electrocatalytic hydrogen evolution of MOF-derived materials based on conjugated or unconjugated ligands CrystEngComm, 2024, 26, 370-380 |
| 7247846 | CIF | C14 H26 Cl8 Co2 N4 O2 | P 1 21/n 1 | 8.8956; 14.3091; 10.4218 90; 92.766; 90 | 1325.02 | Li, Haitao; Guo, Zhenwei; Liu, Tie; Xin, Lianxin; Guo, Fang Solid-state reaction among [CoCl4]2−, [CuCl4]2− and [CuCl4(H2O)]2− ions through transmetalation and liquid-assisted grinding CrystEngComm, 2024, 26, 381-387 |
| 7247847 | CIF | C14 H26 Cl8 N4 O2 Zn2 | P 1 21/n 1 | 8.9266; 14.2573; 10.4071 90; 92.659; 90 | 1323.1 | Li, Haitao; Guo, Zhenwei; Liu, Tie; Xin, Lianxin; Guo, Fang Solid-state reaction among [CoCl4]2−, [CuCl4]2− and [CuCl4(H2O)]2− ions through transmetalation and liquid-assisted grinding CrystEngComm, 2024, 26, 381-387 |
| 7247848 | CIF | C14 H22 Cl6 Cu N4 | P 1 2/c 1 | 9.1035; 5.0596; 23.3576 90; 93.543; 90 | 1073.8 | Li, Haitao; Guo, Zhenwei; Liu, Tie; Xin, Lianxin; Guo, Fang Solid-state reaction among [CoCl4]2−, [CuCl4]2− and [CuCl4(H2O)]2− ions through transmetalation and liquid-assisted grinding CrystEngComm, 2024, 26, 381-387 |
| 7247849 | CIF | C14 H26 Cl8 Cu2 N4 O2 | P -1 | 6.3666; 9.1403; 11.6139 74.548; 88.019; 80.64 | 642.71 | Li, Haitao; Guo, Zhenwei; Liu, Tie; Xin, Lianxin; Guo, Fang Solid-state reaction among [CoCl4]2−, [CuCl4]2− and [CuCl4(H2O)]2− ions through transmetalation and liquid-assisted grinding CrystEngComm, 2024, 26, 381-387 |
| 7247865 | CIF | C22 H24 Cl N O4 | P 1 21 1 | 15.207; 5.1052; 26.456 90; 99.547; 90 | 2025.5 | De Beer, Francois J.; Jacobs, Frederick J. F.; Ntsila, Akho; Kama, Dumisani V.; Azov, Vladimir A. Analysis of short contacts in crystals of halogenated amino acids: atom–atom interactions vs. energy frameworks CrystEngComm, 2024, 26, 604-619 |
| 7247866 | CIF | C9 H16 I N O4 | P 21 21 21 | 5.1261; 8.728; 29.053 90; 90; 90 | 1299.8 | De Beer, Francois J.; Jacobs, Frederick J. F.; Ntsila, Akho; Kama, Dumisani V.; Azov, Vladimir A. Analysis of short contacts in crystals of halogenated amino acids: atom–atom interactions vs. energy frameworks CrystEngComm, 2024, 26, 604-619 |
| 7247867 | CIF | C12 H22 I N O4 | P 21 21 21 | 5.4467; 11.4173; 25.107 90; 90; 90 | 1561.3 | De Beer, Francois J.; Jacobs, Frederick J. F.; Ntsila, Akho; Kama, Dumisani V.; Azov, Vladimir A. Analysis of short contacts in crystals of halogenated amino acids: atom–atom interactions vs. energy frameworks CrystEngComm, 2024, 26, 604-619 |
| 7247868 | CIF | C24 H44 Cl2 N2 O8 | P 1 21 1 | 5.9666; 9.8723; 12.6022 90; 93.118; 90 | 741.22 | De Beer, Francois J.; Jacobs, Frederick J. F.; Ntsila, Akho; Kama, Dumisani V.; Azov, Vladimir A. Analysis of short contacts in crystals of halogenated amino acids: atom–atom interactions vs. energy frameworks CrystEngComm, 2024, 26, 604-619 |
| 7247869 | CIF | C15 H20 I N O4 | P 31 | 16.6588; 16.6588; 5.174 90; 90; 120 | 1243.5 | De Beer, Francois J.; Jacobs, Frederick J. F.; Ntsila, Akho; Kama, Dumisani V.; Azov, Vladimir A. Analysis of short contacts in crystals of halogenated amino acids: atom–atom interactions vs. energy frameworks CrystEngComm, 2024, 26, 604-619 |
| 7247870 | CIF | C9 H16 Cl N O4 | P 1 21 1 | 9.224; 5.0773; 13.2741 90; 107.467; 90 | 593 | De Beer, Francois J.; Jacobs, Frederick J. F.; Ntsila, Akho; Kama, Dumisani V.; Azov, Vladimir A. Analysis of short contacts in crystals of halogenated amino acids: atom–atom interactions vs. energy frameworks CrystEngComm, 2024, 26, 604-619 |
| 7247871 | CIF | C15 H20 Cl N O4 | P 21 21 21 | 5.1069; 11.791; 26.327 90; 90; 90 | 1585.3 | De Beer, Francois J.; Jacobs, Frederick J. F.; Ntsila, Akho; Kama, Dumisani V.; Azov, Vladimir A. Analysis of short contacts in crystals of halogenated amino acids: atom–atom interactions vs. energy frameworks CrystEngComm, 2024, 26, 604-619 |
| 7247877 | CIF | C43 H40 Cd2 N6 O15 | P -1 | 9.9297; 10.5228; 21.8433 94.3066; 95.3186; 107.106 | 2159.41 | Chen, Chia-Ling; Wang, Song-Wei; Zhong, Shih-Ying; Chen, Jhy-Der Cd(ii) coordination polymers constructed from tris-pyridyl-tris-amide and polycarboxylic acid: synthesis, structures and sensing properties CrystEngComm, 2024, 26, 431-438 |
| 7247878 | CIF | C72 H96 Cd3 N12 O39 | R 3 c :H | 20.134; 20.134; 38.292 90; 90; 120 | 13443 | Chen, Chia-Ling; Wang, Song-Wei; Zhong, Shih-Ying; Chen, Jhy-Der Cd(ii) coordination polymers constructed from tris-pyridyl-tris-amide and polycarboxylic acid: synthesis, structures and sensing properties CrystEngComm, 2024, 26, 431-438 |
| 7247879 | CIF | C41 H36 Cd N6 O9 | P 1 21/n 1 | 10.6729; 27.5687; 13.9401 90; 108.001; 90 | 3900.94 | Chen, Chia-Ling; Wang, Song-Wei; Zhong, Shih-Ying; Chen, Jhy-Der Cd(ii) coordination polymers constructed from tris-pyridyl-tris-amide and polycarboxylic acid: synthesis, structures and sensing properties CrystEngComm, 2024, 26, 431-438 |
| 7247886 | CIF | C18 H14 Cd N12 O14 | P 1 21/n 1 | 10.7851; 5.4371; 22.4992 90; 91.358; 90 | 1318.98 | Singla, Priyanka; Soni, Pramod Kumar; Singh, Arjun; Sahoo, Subash Chandra Constructing energetic coordination polymers through mixed-ligand strategy: way to achieve reduced sensitivity with significant energetic performance CrystEngComm, 2024, 26, 494-503 |
| 7247887 | CIF | C18 H14 N12 O14 Zn | P 1 21/n 1 | 10.5932; 5.3285; 22.3376 90; 92.928; 90 | 1259.22 | Singla, Priyanka; Soni, Pramod Kumar; Singh, Arjun; Sahoo, Subash Chandra Constructing energetic coordination polymers through mixed-ligand strategy: way to achieve reduced sensitivity with significant energetic performance CrystEngComm, 2024, 26, 494-503 |
| 7247888 | CIF | C20 H18 Cu N4 O9 | P 65 2 2 | 18.8181; 18.8181; 23.6351 90; 90; 120 | 7248.4 | Dai, Wen; Zhang, Chuanming; Yang, Xiaoang; Li, Lincai Highly efficient iodine uptake and iodate selective probe in a 3D honeycomb-like copper–organic framework based on in situ ligand transformation CrystEngComm, 2024, 26, 773-782 |
| 7247889 | CIF | C18 H22 Cl2 Cu N8 O10 | I 1 2/a 1 | 9.6542; 15.3891; 16.7669 90; 97.803; 90 | 2468 | Donaldson, Marryllyn E.; Dais, Tyson N.; Rowlands, Gareth J.; Matheson, Brodie E.; Plieger, Paul G. Adaptable 2,5-bis((1,2,3-triazol-4-yl)methoxy)pyrazine ligands for the simple self-assembly of homoleptic 1D coordination polymers CrystEngComm, 2024, 26, 504-516 |
| 7247890 | CIF | C20 H30 B2 F8 N8 O2 Zn | C 1 2/c 1 | 19.535; 14.0069; 10.0241 90; 90.699; 90 | 2742.6 | Donaldson, Marryllyn E.; Dais, Tyson N.; Rowlands, Gareth J.; Matheson, Brodie E.; Plieger, Paul G. Adaptable 2,5-bis((1,2,3-triazol-4-yl)methoxy)pyrazine ligands for the simple self-assembly of homoleptic 1D coordination polymers CrystEngComm, 2024, 26, 504-516 |
| 7247891 | CIF | C26 H24 F6 N8 O11 S2 Zn | C 1 2/c 1 | 18.3983; 18.9979; 10.4012 90; 97.843; 90 | 3601.5 | Donaldson, Marryllyn E.; Dais, Tyson N.; Rowlands, Gareth J.; Matheson, Brodie E.; Plieger, Paul G. Adaptable 2,5-bis((1,2,3-triazol-4-yl)methoxy)pyrazine ligands for the simple self-assembly of homoleptic 1D coordination polymers CrystEngComm, 2024, 26, 504-516 |
| 7247892 | CIF | C20 H30 Cl2 Cu N8 O10 | C 1 2/c 1 | 18.58; 16.19; 9.4572 90; 92.654; 90 | 2841.8 | Donaldson, Marryllyn E.; Dais, Tyson N.; Rowlands, Gareth J.; Matheson, Brodie E.; Plieger, Paul G. Adaptable 2,5-bis((1,2,3-triazol-4-yl)methoxy)pyrazine ligands for the simple self-assembly of homoleptic 1D coordination polymers CrystEngComm, 2024, 26, 504-516 |
| 7247893 | CIF | C28 H26 Cu F6 N8 O8 S2 | P -1 | 6.8471; 7.8394; 16.1936 77.929; 85.53; 80.67 | 837.89 | Donaldson, Marryllyn E.; Dais, Tyson N.; Rowlands, Gareth J.; Matheson, Brodie E.; Plieger, Paul G. Adaptable 2,5-bis((1,2,3-triazol-4-yl)methoxy)pyrazine ligands for the simple self-assembly of homoleptic 1D coordination polymers CrystEngComm, 2024, 26, 504-516 |
| 7247894 | CIF | C27 H30 Cl2 N8 O11 Zn | P -1 | 9.8837; 12.5723; 13.0446 85.637; 84.688; 88.395 | 1608.94 | Donaldson, Marryllyn E.; Dais, Tyson N.; Rowlands, Gareth J.; Matheson, Brodie E.; Plieger, Paul G. Adaptable 2,5-bis((1,2,3-triazol-4-yl)methoxy)pyrazine ligands for the simple self-assembly of homoleptic 1D coordination polymers CrystEngComm, 2024, 26, 504-516 |
| 7247895 | CIF | C20 H30 Cl2 N8 Ni O10 | C 1 2/c 1 | 18.5166; 16.2958; 9.3201 90; 92.768; 90 | 2809 | Donaldson, Marryllyn E.; Dais, Tyson N.; Rowlands, Gareth J.; Matheson, Brodie E.; Plieger, Paul G. Adaptable 2,5-bis((1,2,3-triazol-4-yl)methoxy)pyrazine ligands for the simple self-assembly of homoleptic 1D coordination polymers CrystEngComm, 2024, 26, 504-516 |
| 7247896 | CIF | C27 H30 Cl2 Co N8 O11 | P -1 | 9.8467; 12.6342; 12.9571 85.731; 85.591; 88.909 | 1602.56 | Donaldson, Marryllyn E.; Dais, Tyson N.; Rowlands, Gareth J.; Matheson, Brodie E.; Plieger, Paul G. Adaptable 2,5-bis((1,2,3-triazol-4-yl)methoxy)pyrazine ligands for the simple self-assembly of homoleptic 1D coordination polymers CrystEngComm, 2024, 26, 504-516 |
| 7247897 | CIF | C20 H30.5 Cl2 Fe N8 O10.25 | P 1 21/n 1 | 10.0299; 13.9025; 19.959 90; 90; 90 | 2783.1 | Donaldson, Marryllyn E.; Dais, Tyson N.; Rowlands, Gareth J.; Matheson, Brodie E.; Plieger, Paul G. Adaptable 2,5-bis((1,2,3-triazol-4-yl)methoxy)pyrazine ligands for the simple self-assembly of homoleptic 1D coordination polymers CrystEngComm, 2024, 26, 504-516 |
| 7247898 | CIF | C25 H24.5 Cl3.5 Mn N8 O10.5 | P -1 | 9.7671; 12.2209; 13.5331 87.818; 81.123; 83.122 | 1584.2 | Donaldson, Marryllyn E.; Dais, Tyson N.; Rowlands, Gareth J.; Matheson, Brodie E.; Plieger, Paul G. Adaptable 2,5-bis((1,2,3-triazol-4-yl)methoxy)pyrazine ligands for the simple self-assembly of homoleptic 1D coordination polymers CrystEngComm, 2024, 26, 504-516 |
| 7247904 | CIF | C22 H24 Br F N4 O2 | F d d 2 | 24.217; 42.642; 8.474 90; 90; 90 | 8750.8 | Bandaru, Ravi Kumar; Giri, Lopamudra; Krishna, Gamidi Rama; Dandela, Rambabu Novel molecular adducts of an anti-cancer drug vandetanib with enhanced solubility CrystEngComm, 2024, 26, 248-260 |
| 7247905 | CIF | C24 H27 Br F N4 O4 | P -1 | 9.789; 9.937; 12.479 75.4; 82.79; 75.88 | 1136.5 | Bandaru, Ravi Kumar; Giri, Lopamudra; Krishna, Gamidi Rama; Dandela, Rambabu Novel molecular adducts of an anti-cancer drug vandetanib with enhanced solubility CrystEngComm, 2024, 26, 248-260 |
| 7247906 | CIF | C58 H76 Br2 F2 N8 O14.5 | P -1 | 8.929; 12.655; 28.459 80.46; 89.09; 71.38 | 3002.9 | Bandaru, Ravi Kumar; Giri, Lopamudra; Krishna, Gamidi Rama; Dandela, Rambabu Novel molecular adducts of an anti-cancer drug vandetanib with enhanced solubility CrystEngComm, 2024, 26, 248-260 |
| 7247907 | CIF | C31 H42 Br F N4 O7 | P -1 | 8.866; 14.05; 14.358 117.44; 94.18; 95.2 | 1567.4 | Bandaru, Ravi Kumar; Giri, Lopamudra; Krishna, Gamidi Rama; Dandela, Rambabu Novel molecular adducts of an anti-cancer drug vandetanib with enhanced solubility CrystEngComm, 2024, 26, 248-260 |
| 7247908 | CIF | C28 H40 Br F N4 O9 | P -1 | 8.913; 12.55; 14.54 100.34; 96.88; 91.489 | 1586.6 | Bandaru, Ravi Kumar; Giri, Lopamudra; Krishna, Gamidi Rama; Dandela, Rambabu Novel molecular adducts of an anti-cancer drug vandetanib with enhanced solubility CrystEngComm, 2024, 26, 248-260 |
| 7247909 | CIF | C32 H42 Br F N4 O6 | P -1 | 10.149; 13.513; 13.857 113.16; 106.52; 98.22 | 1603.6 | Bandaru, Ravi Kumar; Giri, Lopamudra; Krishna, Gamidi Rama; Dandela, Rambabu Novel molecular adducts of an anti-cancer drug vandetanib with enhanced solubility CrystEngComm, 2024, 26, 248-260 |
| 7247910 | CIF | C42 H30 | P n a 21 | 11.9478; 11.6849; 19.94 90; 90; 90 | 2784 | Turner, Gemma F.; Stapleton, Nicholas; Brookes, James; Spagnoli, Dino; Sussardi, Alif N.; Jones, Anita C.; McGonigal, Paul R.; Moggach, Stephen A. The crystal structure of hexaphenylbenzene under high hydrostatic pressure CrystEngComm, 2024, 26, 459-467 |
| 7247911 | CIF | C42 H30 | P 1 21/c 1 | 11.4952; 19.71; 11.7143 90; 91.02; 90 | 2654 | Turner, Gemma F.; Stapleton, Nicholas; Brookes, James; Spagnoli, Dino; Sussardi, Alif N.; Jones, Anita C.; McGonigal, Paul R.; Moggach, Stephen A. The crystal structure of hexaphenylbenzene under high hydrostatic pressure CrystEngComm, 2024, 26, 459-467 |
| 7247912 | CIF | C42 H30 | P 1 21/c 1 | 11.4968; 19.231; 11.6579 90; 91.196; 90 | 2576.9 | Turner, Gemma F.; Stapleton, Nicholas; Brookes, James; Spagnoli, Dino; Sussardi, Alif N.; Jones, Anita C.; McGonigal, Paul R.; Moggach, Stephen A. The crystal structure of hexaphenylbenzene under high hydrostatic pressure CrystEngComm, 2024, 26, 459-467 |
| 7247913 | CIF | C42 H30 | P 1 21/c 1 | 11.4453; 18.97; 11.5585 90; 91.276; 90 | 2509 | Turner, Gemma F.; Stapleton, Nicholas; Brookes, James; Spagnoli, Dino; Sussardi, Alif N.; Jones, Anita C.; McGonigal, Paul R.; Moggach, Stephen A. The crystal structure of hexaphenylbenzene under high hydrostatic pressure CrystEngComm, 2024, 26, 459-467 |
| 7247914 | CIF | C42 H30 | P n a 21 | 12.179; 11.8019; 20.61 90; 90; 90 | 2962 | Turner, Gemma F.; Stapleton, Nicholas; Brookes, James; Spagnoli, Dino; Sussardi, Alif N.; Jones, Anita C.; McGonigal, Paul R.; Moggach, Stephen A. The crystal structure of hexaphenylbenzene under high hydrostatic pressure CrystEngComm, 2024, 26, 459-467 |
| 7247915 | CIF | C42 H30 | P n a 21 | 12.182; 11.79; 20.8728 90; 90; 90 | 2997.87 | Turner, Gemma F.; Stapleton, Nicholas; Brookes, James; Spagnoli, Dino; Sussardi, Alif N.; Jones, Anita C.; McGonigal, Paul R.; Moggach, Stephen A. The crystal structure of hexaphenylbenzene under high hydrostatic pressure CrystEngComm, 2024, 26, 459-467 |
| 7247916 | CIF | C10 H9 Br N16 O16 | P 1 21 1 | 9.2164; 12.1632; 9.8754 90; 96.584; 90 | 1099.74 | Jing, Suming; Deng, Jiahao; Li, Cong; Liu, Yucun; Zhu, Jin; Wang, Yuanyuan; Zhang, Wei; Liu, Jia High energy explosive with low sensitivity: a new energetic cocrystal based on CL-20 and BMDNP CrystEngComm, 2024, 26, 1126-1132 |
| 7247923 | CIF | C6 H10 N3 O6 Tc | P 1 | 9.9684; 10.4769; 11.0045 89.147; 87.966; 62.592 | 1019.6 | Novikov, Anton P.; Safonov, Alexey V.; German, Konstantin E.; Grigoriev, Mikhail S. What kind of interactions we may get moving from zwitter to “dritter” ions: C–O⋯Re(O4) and Re–O⋯Re(O4) anion⋯anion interactions make structural difference between l-histidinium perrhenate and pertechnetate CrystEngComm, 2024, 26, 61-69 |
| 7247924 | CIF | C6 H10 N3 O6 Re | P 21 21 21 | 9.2915; 17.0748; 19.5885 90; 90; 90 | 3107.73 | Novikov, Anton P.; Safonov, Alexey V.; German, Konstantin E.; Grigoriev, Mikhail S. What kind of interactions we may get moving from zwitter to “dritter” ions: C–O⋯Re(O4) and Re–O⋯Re(O4) anion⋯anion interactions make structural difference between l-histidinium perrhenate and pertechnetate CrystEngComm, 2024, 26, 61-69 |
| 7247925 | CIF | C11 H9 Br2 N O5 Zn | P 1 21/n 1 | 12.8068; 9.5159; 16.9226 90; 111.994; 90 | 1912.24 | Meekel, Emily G.; Nicholas, Thomas C.; Slater, Ben; Goodwin, Andrew L. Torsional flexibility in zinc-benzenedicarboxylate metal-organic frameworks. CrystEngComm, 2024, 26, 673-680 |
| 7247926 | CIF | C8 H3 Br O4 Zn | R -3 m :H | 28.4852; 28.4852; 7.9052 90; 90; 120 | 5554.97 | Meekel, Emily G.; Nicholas, Thomas C.; Slater, Ben; Goodwin, Andrew L. Torsional flexibility in zinc-benzenedicarboxylate metal-organic frameworks. CrystEngComm, 2024, 26, 673-680 |
| 7247927 | CIF | C8 H3 Cl O4 Zn | R -3 m :H | 28.4445; 28.4445; 7.8224 90; 90; 120 | 5481.09 | Meekel, Emily G.; Nicholas, Thomas C.; Slater, Ben; Goodwin, Andrew L. Torsional flexibility in zinc-benzenedicarboxylate metal-organic frameworks. CrystEngComm, 2024, 26, 673-680 |
| 7247928 | CIF | C10 H8 O5 Zn | P 21 21 21 | 11.0562; 12.6155; 15.2102 90; 90; 90 | 2121.51 | Meekel, Emily G.; Nicholas, Thomas C.; Slater, Ben; Goodwin, Andrew L. Torsional flexibility in zinc-benzenedicarboxylate metal-organic frameworks. CrystEngComm, 2024, 26, 673-680 |
| 7247929 | CIF | C8 H3 I O4 Zn | R -3 m :H | 28.5799; 28.5799; 8.0913 90; 90; 120 | 5723.61 | Meekel, Emily G.; Nicholas, Thomas C.; Slater, Ben; Goodwin, Andrew L. Torsional flexibility in zinc-benzenedicarboxylate metal-organic frameworks. CrystEngComm, 2024, 26, 673-680 |
| 7247930 | CIF | C8 H3 Br0.41 Cl0.59 O4 Zn | R -3 m :H | 28.4902; 28.4902; 7.9073 90; 90; 120 | 5558.4 | Meekel, Emily G.; Nicholas, Thomas C.; Slater, Ben; Goodwin, Andrew L. Torsional flexibility in zinc-benzenedicarboxylate metal-organic frameworks. CrystEngComm, 2024, 26, 673-680 |
| 7247932 | CIF | C6 H9 K5 N10 O6 | P -3 c 1 | 10.3592; 10.3592; 20.7675 90; 90; 120 | 1930.04 | Jiang, Shuaijie; Zhou, Jianxin; Xu, Yuangang; Lin, Qiuhan; Wang, Pengcheng; Lu, Ming Regulation of the structure and density of KN5 frameworks with CH3COOK and CF3COOK CrystEngComm, 2024, 26, 951-956 |
| 7247933 | CIF | C12 F18 K8 N10 O12 | P n a 21 | 23.7161; 7.198; 20.5953 90; 90; 90 | 3515.8 | Jiang, Shuaijie; Zhou, Jianxin; Xu, Yuangang; Lin, Qiuhan; Wang, Pengcheng; Lu, Ming Regulation of the structure and density of KN5 frameworks with CH3COOK and CF3COOK CrystEngComm, 2024, 26, 951-956 |
| 7247947 | CIF | C10 H20 N6 O | P 1 21/n 1 | 9.515; 12.609; 11.115 90; 103.185; 90 | 1298.4 | Jiang, Tianyu; Xia, Honglei; Zhang, Wenquan; Cai, Ziwu; Song, Siwei; Liu, Tianlin Can cage-like cations function as antagonistic ions towards pentazolate anions? CrystEngComm, 2024, 26, 977-984 |
| 7247948 | CIF | C6 H16 N12 O | P 1 21/m 1 | 6.2573; 13.544; 7.2073 90; 92.963; 90 | 609.99 | Jiang, Tianyu; Xia, Honglei; Zhang, Wenquan; Cai, Ziwu; Song, Siwei; Liu, Tianlin Can cage-like cations function as antagonistic ions towards pentazolate anions? CrystEngComm, 2024, 26, 977-984 |
| 7247952 | CIF | C8 H15 N3 O4 | P 1 21 1 | 5.0351; 25.7114; 8.667 90; 106.89; 90 | 1073.63 | Fu, Jinqiu; Cai, Mengyang; Shi, Yuzhong; Hou, Yihang; Guo, Rongxi; Wang, Chiyi; Zhao, Jingjing; Zhuang, Wei; Ying, Hanjie; Yang, Pengpeng; Zhang, Keke Discovery and exploration of new solid forms of dipeptide: l-alanyl-l-glutamine CrystEngComm, 2024, 26, 943-950 |
| 7247953 | CIF | C8 H15 N3 O4 | P 21 21 21 | 5.0339; 16.1821; 16.2812 90; 90; 90 | 1326.25 | Fu, Jinqiu; Cai, Mengyang; Shi, Yuzhong; Hou, Yihang; Guo, Rongxi; Wang, Chiyi; Zhao, Jingjing; Zhuang, Wei; Ying, Hanjie; Yang, Pengpeng; Zhang, Keke Discovery and exploration of new solid forms of dipeptide: l-alanyl-l-glutamine CrystEngComm, 2024, 26, 943-950 |
| 7247954 | CIF | C10 H21 N3 O5 S | P 1 21 1 | 4.9438; 17.0476; 8.7107 90; 105.326; 90 | 708.03 | Fu, Jinqiu; Cai, Mengyang; Shi, Yuzhong; Hou, Yihang; Guo, Rongxi; Wang, Chiyi; Zhao, Jingjing; Zhuang, Wei; Ying, Hanjie; Yang, Pengpeng; Zhang, Keke Discovery and exploration of new solid forms of dipeptide: l-alanyl-l-glutamine CrystEngComm, 2024, 26, 943-950 |
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