Crystallography Open Database
Search results
Result: there are 261 entries in the selection
Switch to the old layout of the pageDownload all results as: list of COD numbers | list of CIF URLs | data in CSV format | archive of CIF files (ZIP)
Searching journal of publication like 'CrystEngComm' volume of publication is 24
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1566629 | CIF | C18 H26 Cd N4 O6 P2 S4 | P -1 | 7.2387; 9.6411; 10.4545 81.448; 75.399; 70.165 | 662.56 | Tan, Yee Seng; Yeo, Chien Ing; Kwong, Huey Chong; Tiekink, Edward R. T. Unusual {⋯HNC <sub>2</sub> O⋯HC <sub> <i>n</i> </sub> O}, <i>n</i> = 1 or 2, synthons predominate in the molecular packing of one-dimensional coordination polymers, {Cd[S <sub>2</sub> P(OR) <sub>2</sub> ] <sub>2</sub> ( <sup>3</sup> LH <sub>2</sub> )} <sub> <i>n</i> </sub> , for R = Me and Et, but are precluded when R = i-Pr; <sup>3</sup> LH <sub>2</sub> = <i>N</i> , <i>N</i> ′-bis(3-pyridylmethyl)oxalamide CrystEngComm, 2022, 24, 2992-3004 |
| 1566630 | CIF | C26 H42 Cd N4 O6 P2 S4 | P -1 | 9.9154; 12.3655; 15.4749 106.08; 99.172; 91.827 | 1794.03 | Tan, Yee Seng; Yeo, Chien Ing; Kwong, Huey Chong; Tiekink, Edward R. T. Unusual {⋯HNC <sub>2</sub> O⋯HC <sub> <i>n</i> </sub> O}, <i>n</i> = 1 or 2, synthons predominate in the molecular packing of one-dimensional coordination polymers, {Cd[S <sub>2</sub> P(OR) <sub>2</sub> ] <sub>2</sub> ( <sup>3</sup> LH <sub>2</sub> )} <sub> <i>n</i> </sub> , for R = Me and Et, but are precluded when R = i-Pr; <sup>3</sup> LH <sub>2</sub> = <i>N</i> , <i>N</i> ′-bis(3-pyridylmethyl)oxalamide CrystEngComm, 2022, 24, 2992-3004 |
| 1566631 | CIF | C22 H34 Cd N4 O6 P2 S4 | P -1 | 9.0611; 9.2065; 10.5703 82.436; 77.672; 64.113 | 774.27 | Tan, Yee Seng; Yeo, Chien Ing; Kwong, Huey Chong; Tiekink, Edward R. T. Unusual {⋯HNC <sub>2</sub> O⋯HC <sub> <i>n</i> </sub> O}, <i>n</i> = 1 or 2, synthons predominate in the molecular packing of one-dimensional coordination polymers, {Cd[S <sub>2</sub> P(OR) <sub>2</sub> ] <sub>2</sub> ( <sup>3</sup> LH <sub>2</sub> )} <sub> <i>n</i> </sub> , for R = Me and Et, but are precluded when R = i-Pr; <sup>3</sup> LH <sub>2</sub> = <i>N</i> , <i>N</i> ′-bis(3-pyridylmethyl)oxalamide CrystEngComm, 2022, 24, 2992-3004 |
| 7243734 | CIF | C16 H24 N12 O8 Pb2 S2 | P -1 | 7.0314; 10.5042; 10.5476 61.155; 87.596; 71.433 | 640.99 | García-Santos, Isabel; Castiñeiras, Alfonso; Mahmoudi, Ghodrat; Babashkina, Maria G.; Zangrando, Ennio; Gomila, Rosa M.; Frontera, Antonio; Safin, Damir A. Lead(ii) supramolecular structures formed through a cooperative influence of the hydrazinecarbothioamide derived and ancillary ligands CrystEngComm, 2022, 24, 368-378 |
| 7243735 | CIF | C12 H14 N14 O6 Pb2 S2 | P -1 | 7.1834; 7.7618; 10.873 89.66; 76.812; 71.301 | 557.61 | García-Santos, Isabel; Castiñeiras, Alfonso; Mahmoudi, Ghodrat; Babashkina, Maria G.; Zangrando, Ennio; Gomila, Rosa M.; Frontera, Antonio; Safin, Damir A. Lead(ii) supramolecular structures formed through a cooperative influence of the hydrazinecarbothioamide derived and ancillary ligands CrystEngComm, 2022, 24, 368-378 |
| 7243736 | CIF | C18 H22 N12 O Pb2 S4 | C 1 2/c 1 | 20.419; 10.2159; 12.8155 90; 99.731; 90 | 2634.8 | García-Santos, Isabel; Castiñeiras, Alfonso; Mahmoudi, Ghodrat; Babashkina, Maria G.; Zangrando, Ennio; Gomila, Rosa M.; Frontera, Antonio; Safin, Damir A. Lead(ii) supramolecular structures formed through a cooperative influence of the hydrazinecarbothioamide derived and ancillary ligands CrystEngComm, 2022, 24, 368-378 |
| 7243737 | CIF | C17 H26 N12 O8 Pb2 S2 | C 1 2/c 1 | 20.5481; 10.7642; 12.7256 90; 97.74; 90 | 2789.05 | García-Santos, Isabel; Castiñeiras, Alfonso; Mahmoudi, Ghodrat; Babashkina, Maria G.; Zangrando, Ennio; Gomila, Rosa M.; Frontera, Antonio; Safin, Damir A. Lead(ii) supramolecular structures formed through a cooperative influence of the hydrazinecarbothioamide derived and ancillary ligands CrystEngComm, 2022, 24, 368-378 |
| 7243811 | CIF | C16 H40 N14 Ni2 | C 1 2/m 1 | 13.2618; 8.7178; 13.2822 90; 109.205; 90 | 1450.14 | Verma, Abhineet; Bhuvanesh, Nattamai; Reibenspies, Joseph; Tayade, Sakharam B.; Kumbhar, Avinash S.; Bretosh, Kateryna; Sutter, Jean-Pascal; Sunkari, Sailaja S. Structurally characterised new twisted conformer for cyclen, controlled by metal ion complexation as seen in NiII and CuII complexes with halides and pseudohalides CrystEngComm, 2022, 24, 119-131 |
| 7243812 | CIF | C10 H20 N6 Ni S2 | R 3 c :H | 22.9171; 22.9171; 15.2853 90; 90; 120 | 6952.2 | Verma, Abhineet; Bhuvanesh, Nattamai; Reibenspies, Joseph; Tayade, Sakharam B.; Kumbhar, Avinash S.; Bretosh, Kateryna; Sutter, Jean-Pascal; Sunkari, Sailaja S. Structurally characterised new twisted conformer for cyclen, controlled by metal ion complexation as seen in NiII and CuII complexes with halides and pseudohalides CrystEngComm, 2022, 24, 119-131 |
| 7243813 | CIF | C12 H20 N10 Ni | P b c a | 12.842; 14.8998; 16.5728 90; 90; 90 | 3171.1 | Verma, Abhineet; Bhuvanesh, Nattamai; Reibenspies, Joseph; Tayade, Sakharam B.; Kumbhar, Avinash S.; Bretosh, Kateryna; Sutter, Jean-Pascal; Sunkari, Sailaja S. Structurally characterised new twisted conformer for cyclen, controlled by metal ion complexation as seen in NiII and CuII complexes with halides and pseudohalides CrystEngComm, 2022, 24, 119-131 |
| 7243814 | CIF | C10 H20 Cu N6 S2 | P 21 21 21 | 12.8292; 13.3387; 18.2848 90; 90; 90 | 3129 | Verma, Abhineet; Bhuvanesh, Nattamai; Reibenspies, Joseph; Tayade, Sakharam B.; Kumbhar, Avinash S.; Bretosh, Kateryna; Sutter, Jean-Pascal; Sunkari, Sailaja S. Structurally characterised new twisted conformer for cyclen, controlled by metal ion complexation as seen in NiII and CuII complexes with halides and pseudohalides CrystEngComm, 2022, 24, 119-131 |
| 7243815 | CIF | C8 H20 Br2 Cu N4 | P 4/n m m :2 | 9.5813; 9.5813; 7.5171 90; 90; 90 | 690.08 | Verma, Abhineet; Bhuvanesh, Nattamai; Reibenspies, Joseph; Tayade, Sakharam B.; Kumbhar, Avinash S.; Bretosh, Kateryna; Sutter, Jean-Pascal; Sunkari, Sailaja S. Structurally characterised new twisted conformer for cyclen, controlled by metal ion complexation as seen in NiII and CuII complexes with halides and pseudohalides CrystEngComm, 2022, 24, 119-131 |
| 7243816 | CIF | C8 H20 Cu N10 | P 1 21/n 1 | 8.3568; 14.4655; 11.2207 90; 92.8489; 90 | 1354.74 | Verma, Abhineet; Bhuvanesh, Nattamai; Reibenspies, Joseph; Tayade, Sakharam B.; Kumbhar, Avinash S.; Bretosh, Kateryna; Sutter, Jean-Pascal; Sunkari, Sailaja S. Structurally characterised new twisted conformer for cyclen, controlled by metal ion complexation as seen in NiII and CuII complexes with halides and pseudohalides CrystEngComm, 2022, 24, 119-131 |
| 7243817 | CIF | C10 H23 Br N4 Ni O2 | P n m a | 15.1276; 8.9116; 11.1889 90; 90; 90 | 1508.39 | Verma, Abhineet; Bhuvanesh, Nattamai; Reibenspies, Joseph; Tayade, Sakharam B.; Kumbhar, Avinash S.; Bretosh, Kateryna; Sutter, Jean-Pascal; Sunkari, Sailaja S. Structurally characterised new twisted conformer for cyclen, controlled by metal ion complexation as seen in NiII and CuII complexes with halides and pseudohalides CrystEngComm, 2022, 24, 119-131 |
| 7243889 | CIF | C32 H34 Cl3 N O3 | P 1 21/c 1 | 11.4556; 26.8887; 9.5696 90; 91.164; 90 | 2947.08 | Tomar, Devendrasingh; Lodagekar, Anurag; Gunnam, Anilkumar; Allu, Suryanarayana; Chavan, Rahul B.; Tharkar, Minakshi; Ajithkumar, T. G.; Nangia, Ashwini K.; Shastri, Nalini R. The effects of cis and trans butenedioic acid on the physicochemical behavior of lumefantrine CrystEngComm, 2022, 24, 156-168 |
| 7243890 | CIF | C24 H22 N4 O4 Zn | P 21 21 21 | 8.3124; 14.5576; 17.939 90; 90; 90 | 2170.8 | Bai, Ye; Zhang, Mei-li; Wang, Bo-Tao; Ren, Yi-Xia; Zhao, Yu-Chao; Yang, Hua; Yang, Xiaogang Four MOFs with isomeric ligands as fluorescent probes for highly selective, sensitive and stable detection of antibiotics in water CrystEngComm, 2022, 24, 169-181 |
| 7243891 | CIF | C24 H26 Cd N4 O6 | P 1 2/n 1 | 9.0815; 19.394; 14.389 90; 101.562; 90 | 2482.9 | Bai, Ye; Zhang, Mei-li; Wang, Bo-Tao; Ren, Yi-Xia; Zhao, Yu-Chao; Yang, Hua; Yang, Xiaogang Four MOFs with isomeric ligands as fluorescent probes for highly selective, sensitive and stable detection of antibiotics in water CrystEngComm, 2022, 24, 169-181 |
| 7243892 | CIF | C18 H23 N O4 | P b c a | 11.7444; 7.6959; 34.758 90; 90; 90 | 3141.6 | Bai, Ye; Zhang, Mei-li; Wang, Bo-Tao; Ren, Yi-Xia; Zhao, Yu-Chao; Yang, Hua; Yang, Xiaogang Four MOFs with isomeric ligands as fluorescent probes for highly selective, sensitive and stable detection of antibiotics in water CrystEngComm, 2022, 24, 169-181 |
| 7243904 | CIF | Cs3 Ga2 H I8 O25 | P 1 21/m 1 | 7.9191; 21.1203; 8.6696 90; 111.691; 90 | 1347.35 | Wang, Dandan; Jiang, Xiaoqing; Gong, Pifu; Zhang, Xinyuan; Lin, Zheshuai; Hu, Zhanggui; Wu, Yicheng A new I3O93− group constructed from IO3− and IO55− anion units in Cs3[Ga2O(I3O9)(IO3)4(HIO3)] CrystEngComm, 2022, 24, 77-82 |
| 7243909 | CIF | C31 H29 N O2 | P b c a | 16.7706; 9.876; 30.6219 90; 90; 90 | 5071.8 | Zhou, Lian; Meng, Wei; Sun, Lin; Du, Lin; Xuan, Xiaopeng; Zhang, Jun Molecular motions of a tetraphenylethylene-derived AIEgen directly monitored through in situ variable temperature single crystal X-ray diffraction CrystEngComm, 2022, 24, 231-234 |
| 7243910 | CIF | C31 H29 N O2 | P b c a | 16.955; 9.9034; 30.69 90; 90; 90 | 5153.2 | Zhou, Lian; Meng, Wei; Sun, Lin; Du, Lin; Xuan, Xiaopeng; Zhang, Jun Molecular motions of a tetraphenylethylene-derived AIEgen directly monitored through in situ variable temperature single crystal X-ray diffraction CrystEngComm, 2022, 24, 231-234 |
| 7243911 | CIF | C31 H29 N O2 | P b c a | 16.8821; 9.894; 30.6933 90; 90; 90 | 5126.7 | Zhou, Lian; Meng, Wei; Sun, Lin; Du, Lin; Xuan, Xiaopeng; Zhang, Jun Molecular motions of a tetraphenylethylene-derived AIEgen directly monitored through in situ variable temperature single crystal X-ray diffraction CrystEngComm, 2022, 24, 231-234 |
| 7243912 | CIF | C31 H29 N O2 | P b c a | 17.015; 9.93; 30.709 90; 90; 90 | 5189 | Zhou, Lian; Meng, Wei; Sun, Lin; Du, Lin; Xuan, Xiaopeng; Zhang, Jun Molecular motions of a tetraphenylethylene-derived AIEgen directly monitored through in situ variable temperature single crystal X-ray diffraction CrystEngComm, 2022, 24, 231-234 |
| 7243913 | CIF | C31 H29 N O2 | P b c a | 16.9294; 9.9015; 30.714 90; 90; 90 | 5148.5 | Zhou, Lian; Meng, Wei; Sun, Lin; Du, Lin; Xuan, Xiaopeng; Zhang, Jun Molecular motions of a tetraphenylethylene-derived AIEgen directly monitored through in situ variable temperature single crystal X-ray diffraction CrystEngComm, 2022, 24, 231-234 |
| 7243914 | CIF | C31 H29 N O2 | P b c a | 17.064; 9.9101; 30.823 90; 90; 90 | 5212.4 | Zhou, Lian; Meng, Wei; Sun, Lin; Du, Lin; Xuan, Xiaopeng; Zhang, Jun Molecular motions of a tetraphenylethylene-derived AIEgen directly monitored through in situ variable temperature single crystal X-ray diffraction CrystEngComm, 2022, 24, 231-234 |
| 7243915 | CIF | C31 H29 N O2 | P b c a | 16.988; 9.9204; 30.779 90; 90; 90 | 5187.1 | Zhou, Lian; Meng, Wei; Sun, Lin; Du, Lin; Xuan, Xiaopeng; Zhang, Jun Molecular motions of a tetraphenylethylene-derived AIEgen directly monitored through in situ variable temperature single crystal X-ray diffraction CrystEngComm, 2022, 24, 231-234 |
| 7243916 | CIF | C31 H29 N O2 | P b c a | 16.8302; 9.886; 30.6702 90; 90; 90 | 5103 | Zhou, Lian; Meng, Wei; Sun, Lin; Du, Lin; Xuan, Xiaopeng; Zhang, Jun Molecular motions of a tetraphenylethylene-derived AIEgen directly monitored through in situ variable temperature single crystal X-ray diffraction CrystEngComm, 2022, 24, 231-234 |
| 7243917 | CIF | C31 H29 N O2 | P b c a | 16.856; 9.8906; 30.6845 90; 90; 90 | 5115.6 | Zhou, Lian; Meng, Wei; Sun, Lin; Du, Lin; Xuan, Xiaopeng; Zhang, Jun Molecular motions of a tetraphenylethylene-derived AIEgen directly monitored through in situ variable temperature single crystal X-ray diffraction CrystEngComm, 2022, 24, 231-234 |
| 7243918 | CIF | C31 H29 N O2 | P b c a | 16.8024; 9.8815; 30.6532 90; 90; 90 | 5089.4 | Zhou, Lian; Meng, Wei; Sun, Lin; Du, Lin; Xuan, Xiaopeng; Zhang, Jun Molecular motions of a tetraphenylethylene-derived AIEgen directly monitored through in situ variable temperature single crystal X-ray diffraction CrystEngComm, 2022, 24, 231-234 |
| 7243919 | CIF | Mo132 N25.8 O628.56 Se30 | R -3 :H | 32.7739; 32.7739; 73.5789 90; 90; 120 | 68444.8 | Korenev, Vladimir S.; Dorovatovskii, Pavel V.; Lazarenko, Vladimir A.; Abramov, Pavel A.; Sokolov, Maxim N. Structural features of selenate based {Mo132} keplerate capsules CrystEngComm, 2022, 24, 321-329 |
| 7243920 | CIF | C21.8 H130.8 Cl3 Mo132 N65.4 O581.4 Se30 | R -3 c :H | 50.337; 50.337; 61.099 90; 90; 120 | 134072 | Korenev, Vladimir S.; Dorovatovskii, Pavel V.; Lazarenko, Vladimir A.; Abramov, Pavel A.; Sokolov, Maxim N. Structural features of selenate based {Mo132} keplerate capsules CrystEngComm, 2022, 24, 321-329 |
| 7243930 | CIF | C44 H42 N6 O6 Zn | P 1 21/c 1 | 16.8783; 14.9191; 16.6035 90; 108.071; 90 | 3974.7 | Su, Yu-Qiao; Wang, Ruo-Tong; Blatova, Olga A.; Shi, Yong-Sheng; Cui, Guang-Hua Two robust Zn(ii)-organic frameworks as dual-functional fluorescent probes for efficient sensing of enrofloxacin and MnO4− anions CrystEngComm, 2022, 24, 182-191 |
| 7243931 | CIF | C123 H93 N12 O22.5 Zn6 | P -1 | 10.8732; 15.9024; 17.0471 105.773; 103.099; 91.265 | 2751.8 | Su, Yu-Qiao; Wang, Ruo-Tong; Blatova, Olga A.; Shi, Yong-Sheng; Cui, Guang-Hua Two robust Zn(ii)-organic frameworks as dual-functional fluorescent probes for efficient sensing of enrofloxacin and MnO4− anions CrystEngComm, 2022, 24, 182-191 |
| 7243956 | CIF | C89.5 H112.5 N2.5 O41 Yb6 | P 1 21/n 1 | 12.4079; 20.8937; 19.4442 90; 90.801; 90 | 5040.4 | Slyusarchuk, Valentyna D.; Hawes, Chris S. Fecht's acid revisited: a spirocyclic dicarboxylate for non-aromatic MOFs CrystEngComm, 2022, 24, 484-490 |
| 7243957 | CIF | C25 H32 N3.33 O6.67 Zn | P n n a | 11.3429; 12.4311; 18.5115 90; 90; 90 | 2610.2 | Slyusarchuk, Valentyna D.; Hawes, Chris S. Fecht's acid revisited: a spirocyclic dicarboxylate for non-aromatic MOFs CrystEngComm, 2022, 24, 484-490 |
| 7243966 | CIF | C13 H6 O6 Tb | P 1 21/c 1 | 12.9504; 12.8021; 6.8288 90; 94.149; 90 | 1129.2 | Qiu, Miao-Miao; Chen, Ke-Fu; Liu, Qi-Rui; Miao, Wei-Ni; Liu, Bing; Xu, Ling A ratiometric fluorescent sensor made of a terbium coordination polymer for the anthrax biomarker 2,6-dipicolinic acid with on-site detection assisted by a smartphone app CrystEngComm, 2022, 24, 132-142 |
| 7243970 | CIF | C30 H25 N5 O2 | P -1 | 11.5136; 14.4562; 16.368 75.824; 85.556; 89.48 | 2633.3 | Liang, Qiong-Fang; Zheng, Han-Wen; Yang, Dong-Dong; Zheng, Xiang-Jun A triphenylamine derivative and its Cd(ii) complex with high-contrast mechanochromic luminescence and vapochromism CrystEngComm, 2022, 24, 543-551 |
| 7243971 | CIF | C26 H21 Cd0.5 Cl N3 O2 | P -1 | 7.2058; 7.774; 20.4876 86.501; 89.897; 83.117 | 1137.26 | Liang, Qiong-Fang; Zheng, Han-Wen; Yang, Dong-Dong; Zheng, Xiang-Jun A triphenylamine derivative and its Cd(ii) complex with high-contrast mechanochromic luminescence and vapochromism CrystEngComm, 2022, 24, 543-551 |
| 7243972 | CIF | C17 H23 Eu N3 O11 | C 1 2/c 1 | 25.0401; 13.9581; 14.3689 90; 102.219; 90 | 4908.3 | Hang, Meng-Ting; Cheng, Yi; Wang, Yi-Tong; Li, Huan; Zheng, Meng-Qi; He, Ming-Yang; Chen, Qun; Zhang, Zhi-Hui Rational synthesis of isomorphic rare earth metal–organic framework materials for simultaneous adsorption and photocatalytic degradation of organic dyes in water CrystEngComm, 2022, 24, 552-559 |
| 7243973 | CIF | C11 H10 Ca N2 O7 | P -1 | 8.4045; 8.6975; 9.854 64.455; 86.316; 74.126 | 623.92 | Teixeira, Michaël; Maia, Renata A.; Karmazin, Lydia; Louis, Benoît; Baudron, Stéphane A. Ionothermal synthesis of calcium-based metal–organic frameworks in a deep eutectic solvent CrystEngComm, 2022, 24, 601-608 |
| 7243974 | CIF | C14 H16 Ca N4 O8 | C 1 2/c 1 | 17.7069; 10.4537; 9.3801 90; 92.379; 90 | 1734.78 | Teixeira, Michaël; Maia, Renata A.; Karmazin, Lydia; Louis, Benoît; Baudron, Stéphane A. Ionothermal synthesis of calcium-based metal–organic frameworks in a deep eutectic solvent CrystEngComm, 2022, 24, 601-608 |
| 7243975 | CIF | C28 H34 Ca2 N8 O17 | P -1 | 10.628; 13.31; 13.741 79.741; 73.155; 71.586 | 1757.1 | Teixeira, Michaël; Maia, Renata A.; Karmazin, Lydia; Louis, Benoît; Baudron, Stéphane A. Ionothermal synthesis of calcium-based metal–organic frameworks in a deep eutectic solvent CrystEngComm, 2022, 24, 601-608 |
| 7243976 | CIF | C11 H10 Ca N2 O5 | P 21 21 21 | 6.7109; 10.271; 17.775 90; 90; 90 | 1225.19 | Teixeira, Michaël; Maia, Renata A.; Karmazin, Lydia; Louis, Benoît; Baudron, Stéphane A. Ionothermal synthesis of calcium-based metal–organic frameworks in a deep eutectic solvent CrystEngComm, 2022, 24, 601-608 |
| 7243977 | CIF | C22 H20 Ca2 N4 O10 | P -1 | 7.0098; 10.9304; 16.616 92.618; 99.659; 102.704 | 1219.82 | Teixeira, Michaël; Maia, Renata A.; Karmazin, Lydia; Louis, Benoît; Baudron, Stéphane A. Ionothermal synthesis of calcium-based metal–organic frameworks in a deep eutectic solvent CrystEngComm, 2022, 24, 601-608 |
| 7243978 | CIF | C22 H20 Ca2 N4 O10 | P 1 21/n 1 | 6.8835; 17.9272; 20.4957 90; 90.043; 90 | 2529.2 | Teixeira, Michaël; Maia, Renata A.; Karmazin, Lydia; Louis, Benoît; Baudron, Stéphane A. Ionothermal synthesis of calcium-based metal–organic frameworks in a deep eutectic solvent CrystEngComm, 2022, 24, 601-608 |
| 7243980 | CIF | C14 H13 Cl In N O7 | C 1 2/c 1 | 19.824; 13.4404; 13.6238 90; 119.291; 90 | 3165.9 | Guo, Xiuli; Li, Zhenhua; Chen, Xiaobo; Liang, Dadong; Li, Chunguang; Li, Guanghua; Wang, Li; Shi, Zhan; Feng, Shouhua Stable isomeric layered indium coordination polymers for high proton conduction CrystEngComm, 2022, 24, 294-299 |
| 7243981 | CIF | C14 H11 In N2 O9 | C 1 2/c 1 | 19.849; 13.4206; 13.6014 90; 119.38; 90 | 3157.2 | Guo, Xiuli; Li, Zhenhua; Chen, Xiaobo; Liang, Dadong; Li, Chunguang; Li, Guanghua; Wang, Li; Shi, Zhan; Feng, Shouhua Stable isomeric layered indium coordination polymers for high proton conduction CrystEngComm, 2022, 24, 294-299 |
| 7243990 | CIF | C8 H24 Cl N O4 | P n a 21 | 11.8741; 8.4164; 12.6736 90; 90; 90 | 1266.56 | Navasardyan, Mger A.; Bezzubov, Stanislav I.; Medvedev, Alexander G.; Prikhodchenko, Petr V.; Churakov, Andrei V. Novel peroxosolvates of tetraalkylammonium halides: the first case of layers containing hydrogen-bonded peroxide molecules CrystEngComm, 2022, 24, 38-42 |
| 7243991 | CIF | C9 H16 Cl N O2 | P 1 21/c 1 | 7.242; 10.069; 14.7992 90; 100.379; 90 | 1061.5 | Navasardyan, Mger A.; Bezzubov, Stanislav I.; Medvedev, Alexander G.; Prikhodchenko, Petr V.; Churakov, Andrei V. Novel peroxosolvates of tetraalkylammonium halides: the first case of layers containing hydrogen-bonded peroxide molecules CrystEngComm, 2022, 24, 38-42 |
| 7243992 | CIF | C5 H15 Cl2 N O2 | P 21 21 21 | 7.5628; 9.9033; 25.3929 90; 90; 90 | 1901.84 | Navasardyan, Mger A.; Bezzubov, Stanislav I.; Medvedev, Alexander G.; Prikhodchenko, Petr V.; Churakov, Andrei V. Novel peroxosolvates of tetraalkylammonium halides: the first case of layers containing hydrogen-bonded peroxide molecules CrystEngComm, 2022, 24, 38-42 |
| 7243993 | CIF | C8 H24 Br N O4 | P n a 21 | 12.0887; 8.5504; 12.7308 90; 90; 90 | 1315.9 | Navasardyan, Mger A.; Bezzubov, Stanislav I.; Medvedev, Alexander G.; Prikhodchenko, Petr V.; Churakov, Andrei V. Novel peroxosolvates of tetraalkylammonium halides: the first case of layers containing hydrogen-bonded peroxide molecules CrystEngComm, 2022, 24, 38-42 |
| 7243994 | CIF | C21 H20 N2 O6 | P 1 21 1 | 7.5119; 7.5163; 17.4195 90; 101.945; 90 | 962.24 | Aitipamula, Srinivasulu; Shan, Loke Pei; Gupta, Krishna M. Polymorphism and distinct physicochemical properties of the phloretin–nicotinamide cocrystal CrystEngComm, 2022, 24, 560-570 |
| 7243995 | CIF | C10 H7 N O2 | C 1 2 1 | 19.7947; 9.4219; 3.5826 90; 98.7506; 90 | 660.39 | Rekis, Toms; Ramakrishnan, Sitaram; Kotla, Surya Rohith; Bao, Jin-Ke; Eisele, Claudio; Schönleber, Andreas; Noohinejad, Leila; Paulmann, Carsten; Tolkiehn, Martin; van Smaalen, Sander Une étude cristallographique: superspace description of a commensurate composite cocrystal of 4,4′-dinitrobiphenyl and biphenyl CrystEngComm, 2022, 24, 512-517 |
| 7243996 | CIF | C10 H7 N O2 | C 1 | 19.7858; 9.397; 3.5684 89.986; 98.729; 89.982 | 655.78 | Rekis, Toms; Ramakrishnan, Sitaram; Kotla, Surya Rohith; Bao, Jin-Ke; Eisele, Claudio; Schönleber, Andreas; Noohinejad, Leila; Paulmann, Carsten; Tolkiehn, Martin; van Smaalen, Sander Une étude cristallographique: superspace description of a commensurate composite cocrystal of 4,4′-dinitrobiphenyl and biphenyl CrystEngComm, 2022, 24, 512-517 |
| 7243997 | CIF | C34 H41 Co F3 N5 O12 S | C 1 c 1 | 16.733; 12.1818; 17.9613 90; 91; 90 | 3660.64 | Melvin, Marissa K.; Skelton, Brian W.; Eggers, Paul K.; Raston, Colin L. Synthesis, crystallization and Hirshfeld surface analysis of transition metal carboxylate pentapyridines CrystEngComm, 2022, 24, 57-69 |
| 7243998 | CIF | C64 H66 Cu4 F12 N10 O26 S4 | P -1 | 12.5531; 13.0741; 14.6993 68.163; 65.87; 64.215 | 1926.33 | Melvin, Marissa K.; Skelton, Brian W.; Eggers, Paul K.; Raston, Colin L. Synthesis, crystallization and Hirshfeld surface analysis of transition metal carboxylate pentapyridines CrystEngComm, 2022, 24, 57-69 |
| 7243999 | CIF | C31 H30.54 F3 N5 Ni O8.27 S | P -1 | 11.0416; 11.7979; 14.2305 104.917; 98.643; 113.012 | 1581.79 | Melvin, Marissa K.; Skelton, Brian W.; Eggers, Paul K.; Raston, Colin L. Synthesis, crystallization and Hirshfeld surface analysis of transition metal carboxylate pentapyridines CrystEngComm, 2022, 24, 57-69 |
| 7244014 | CIF | C56.25 H45.25 N10.75 O1.75 | P b c a | 20.3991; 15.4857; 30.0422 90; 90; 90 | 9490.2 | Manfroni, Giacomo; Prescimone, Alessandro; Constable, Edwin C.; Housecroft, Catherine E. Stars and stripes: hexatopic tris(3,2′:6′,3′′-terpyridine) ligands that unexpectedly form one-dimensional coordination polymers CrystEngComm, 2022, 24, 491-503 |
| 7244015 | CIF | C122 H80.1 Cl1.2 Cu3 F36 N9 O12 | P 1 21/n 1 | 19.889; 21.178; 34.375 90; 104.32; 90 | 14029 | Manfroni, Giacomo; Prescimone, Alessandro; Constable, Edwin C.; Housecroft, Catherine E. Stars and stripes: hexatopic tris(3,2′:6′,3′′-terpyridine) ligands that unexpectedly form one-dimensional coordination polymers CrystEngComm, 2022, 24, 491-503 |
| 7244016 | CIF | C32 H72 Br14 Mo6 N2 | P 1 21/c 1 | 22.82; 11.9888; 22.879 90; 111.912; 90 | 5807.2 | Saito, Norio; Nishiyama, Daiki; Matsushita, Yoshitaka; Wada, Yoshiki; Cordier, Stéphane; Ohsawa, Takeo; Grasset, Fabien; Ohashi, Naoki Reentrant structural and optical properties of organic–inorganic hybrid metal cluster compound ((n-C4H9)4N)2[Mo6Bri8Bra6] CrystEngComm, 2022, 24, 465-470 |
| 7244017 | CIF | C32 H72 Br14 Mo6 N2 | P 1 21/n 1 | 13.0071; 11.6664; 19.0278 90; 90.481; 90 | 2887.3 | Saito, Norio; Nishiyama, Daiki; Matsushita, Yoshitaka; Wada, Yoshiki; Cordier, Stéphane; Ohsawa, Takeo; Grasset, Fabien; Ohashi, Naoki Reentrant structural and optical properties of organic–inorganic hybrid metal cluster compound ((n-C4H9)4N)2[Mo6Bri8Bra6] CrystEngComm, 2022, 24, 465-470 |
| 7244018 | CIF | C32 H72 Br14 Mo6 N2 | P 1 21/n 1 | 13.1355; 11.7629; 18.9747 90; 90.737; 90 | 2931.57 | Saito, Norio; Nishiyama, Daiki; Matsushita, Yoshitaka; Wada, Yoshiki; Cordier, Stéphane; Ohsawa, Takeo; Grasset, Fabien; Ohashi, Naoki Reentrant structural and optical properties of organic–inorganic hybrid metal cluster compound ((n-C4H9)4N)2[Mo6Bri8Bra6] CrystEngComm, 2022, 24, 465-470 |
| 7244019 | CIF | C24 H60 Mo12 N36 Ni7 O60 P | I 4/m | 17.6067; 17.6067; 29.9221 90; 90; 90 | 9275.7 | Zhuo, Jin-Long; Wang, Yun-Liang; Wang, Yu-Guang; Xu, Ming-Qi; Sha, Jing-Quan Surfactant-assisted fabrication and supercapacitor performances of a 12-phosphomolybdate-pillared metal–organic framework containing a helix and its SWNT nanocomposites CrystEngComm, 2022, 24, 579-586 |
| 7244020 | CIF | C52 H98 Cu N24 O128 Si3 W36 | P -1 | 14.767; 16.296; 18.365 71.143; 87.189; 84.839 | 4164.3 | Sun, Chenxi; Ying, Jun; Zhang, Yanping; Jin, Liang; Tian, Aixiang; Wang, Xiuli A series of POM-based compounds by tuning coordination groups and spacers of ligands: electrocatalytic, capacitive and photoelectrocatalytic properties CrystEngComm, 2022, 24, 587-600 |
| 7244021 | CIF | C52 H66 Co Mo24 N24 O82 Si2 | P 1 21/c 1 | 12.1279; 21.743; 21.136 90; 102.364; 90 | 5444.2 | Sun, Chenxi; Ying, Jun; Zhang, Yanping; Jin, Liang; Tian, Aixiang; Wang, Xiuli A series of POM-based compounds by tuning coordination groups and spacers of ligands: electrocatalytic, capacitive and photoelectrocatalytic properties CrystEngComm, 2022, 24, 587-600 |
| 7244022 | CIF | C26 H44 Co3 Mo6 N12 O32 Te | P 1 21/c 1 | 13.7397; 10.2909; 17.8945 90; 105.235; 90 | 2441.3 | Sun, Chenxi; Ying, Jun; Zhang, Yanping; Jin, Liang; Tian, Aixiang; Wang, Xiuli A series of POM-based compounds by tuning coordination groups and spacers of ligands: electrocatalytic, capacitive and photoelectrocatalytic properties CrystEngComm, 2022, 24, 587-600 |
| 7244023 | CIF | C52 H82 Cu5 Mo22 N24 O89 P2 | P c a 21 | 23.2769; 13.9736; 19.3429 90; 90; 90 | 6291.5 | Sun, Chenxi; Ying, Jun; Zhang, Yanping; Jin, Liang; Tian, Aixiang; Wang, Xiuli A series of POM-based compounds by tuning coordination groups and spacers of ligands: electrocatalytic, capacitive and photoelectrocatalytic properties CrystEngComm, 2022, 24, 587-600 |
| 7244024 | CIF | C12 H34 Cr Cu Mo6 N7 O31 | P -1 | 12.2348; 13.557; 13.8907 110.677; 110.381; 98.307 | 1924.4 | Sun, Chenxi; Ying, Jun; Zhang, Yanping; Jin, Liang; Tian, Aixiang; Wang, Xiuli A series of POM-based compounds by tuning coordination groups and spacers of ligands: electrocatalytic, capacitive and photoelectrocatalytic properties CrystEngComm, 2022, 24, 587-600 |
| 7244025 | CIF | C26 H52 Co2 N12 O45.5 P W11 | P 1 21/c 1 | 19.0455; 14.5002; 23.178 90; 95.835; 90 | 6367.8 | Sun, Chenxi; Ying, Jun; Zhang, Yanping; Jin, Liang; Tian, Aixiang; Wang, Xiuli A series of POM-based compounds by tuning coordination groups and spacers of ligands: electrocatalytic, capacitive and photoelectrocatalytic properties CrystEngComm, 2022, 24, 587-600 |
| 7244026 | CIF | C13 H37 Co2 Mo6 N6 Na O35 Te | P -1 | 8.3059; 10.2707; 27.0831 90.502; 95.784; 112.687 | 2117.91 | Sun, Chenxi; Ying, Jun; Zhang, Yanping; Jin, Liang; Tian, Aixiang; Wang, Xiuli A series of POM-based compounds by tuning coordination groups and spacers of ligands: electrocatalytic, capacitive and photoelectrocatalytic properties CrystEngComm, 2022, 24, 587-600 |
| 7244034 | CIF | C30 H25 N5 O2 | P -1 | 11.5136; 14.4562; 16.368 75.824; 85.556; 89.48 | 2633.3 | Giri, Rajat Subhra; Mandal, Bhubaneswar Supramolecular helical self-assembly of small peptides CrystEngComm, 2022, 24, 10-32 |
| 7244035 | CIF | C26 H21 Cd0.5 Cl N3 O2 | P -1 | 7.2058; 7.774; 20.4876 86.501; 89.897; 83.117 | 1137.26 | Giri, Rajat Subhra; Mandal, Bhubaneswar Supramolecular helical self-assembly of small peptides CrystEngComm, 2022, 24, 10-32 |
| 7244036 | CIF | C19 H22 Cl3 N S2 Sn | P 1 21/n 1 | 10.12941; 16.43674; 13.38681 90; 96.9574; 90 | 2212.42 | Tan, Sang Loon; Cardoso, Laura N. F.; de Souza, Marcus V. N.; Wardell, Solange M. S. V.; Wardell, James L.; Tiekink, Edward R. T. Experimental and computational evidence for stabilising parallel, offset π[C(O)N(H)NC]⋯π(phenyl) interactions in acetohydrazide derivatives CrystEngComm, 2022, 24, 962-974 |
| 7244038 | CIF | C13 H9 Cl2 N O2 | P -1 | 7.3849; 8.0981; 11.1254 72.216; 84.21; 74.767 | 611.13 | Zhoujin, Yunping; Li, Yuping; Zhang, Mingtao; Parkin, Sean; Guo, Ju; Li, Tonglei; Yu, Faquan; Long, Sihui Polymorphism and cocrystal salt formation of 2-((2,6-dichlorophenyl)amino)benzoic acid, harvest of a second form of 2-((2,6-dimethylphenyl)amino)benzoic acid, and isomorphism between the two systems CrystEngComm, 2022, 24, 681-690 |
| 7244039 | CIF | C15 H15 N O2 | P 1 21/c 1 | 11.6672; 7.4166; 15.6676 90; 108.305; 90 | 1287.13 | Zhoujin, Yunping; Li, Yuping; Zhang, Mingtao; Parkin, Sean; Guo, Ju; Li, Tonglei; Yu, Faquan; Long, Sihui Polymorphism and cocrystal salt formation of 2-((2,6-dichlorophenyl)amino)benzoic acid, harvest of a second form of 2-((2,6-dimethylphenyl)amino)benzoic acid, and isomorphism between the two systems CrystEngComm, 2022, 24, 681-690 |
| 7244040 | CIF | C13 H9 Cl2 N O2 | P 1 21/n 1 | 12.4611; 6.86735; 15.5404 90; 110.487; 90 | 1245.75 | Zhoujin, Yunping; Li, Yuping; Zhang, Mingtao; Parkin, Sean; Guo, Ju; Li, Tonglei; Yu, Faquan; Long, Sihui Polymorphism and cocrystal salt formation of 2-((2,6-dichlorophenyl)amino)benzoic acid, harvest of a second form of 2-((2,6-dimethylphenyl)amino)benzoic acid, and isomorphism between the two systems CrystEngComm, 2022, 24, 681-690 |
| 7244041 | CIF | C28 H25 Cl4 N3 O4 | P 1 21/c 1 | 14.2255; 24.628; 8.1632 90; 99.282; 90 | 2822.49 | Zhoujin, Yunping; Li, Yuping; Zhang, Mingtao; Parkin, Sean; Guo, Ju; Li, Tonglei; Yu, Faquan; Long, Sihui Polymorphism and cocrystal salt formation of 2-((2,6-dichlorophenyl)amino)benzoic acid, harvest of a second form of 2-((2,6-dimethylphenyl)amino)benzoic acid, and isomorphism between the two systems CrystEngComm, 2022, 24, 681-690 |
| 7244042 | CIF | C12 H5 N7 O8 | P 1 21/n 1 | 6.5565; 17.6948; 12.4912 90; 102.335; 90 | 1415.72 | Baraboshkin, Nikita M.; Zelenov, Victor P.; Minyaev, Mikhail E.; Pivina, Tatyana S. Quest: structure and properties of BTF–nitrobenzene cocrystals with different ratios of components CrystEngComm, 2022, 24, 235-250 |
| 7244043 | CIF | C24 H4 N20 O22 | P -1 | 12.0783; 12.3615; 12.6822 107.053; 95.261; 112.021 | 1634.2 | Baraboshkin, Nikita M.; Zelenov, Victor P.; Minyaev, Mikhail E.; Pivina, Tatyana S. Quest: structure and properties of BTF–nitrobenzene cocrystals with different ratios of components CrystEngComm, 2022, 24, 235-250 |
| 7244044 | CIF | C12 H4 N8 O10 | P 1 21/c 1 | 7.1886; 17.2834; 12.4782 90; 94.337; 90 | 1545.9 | Baraboshkin, Nikita M.; Zelenov, Victor P.; Minyaev, Mikhail E.; Pivina, Tatyana S. Quest: structure and properties of BTF–nitrobenzene cocrystals with different ratios of components CrystEngComm, 2022, 24, 235-250 |
| 7244051 | CIF | C6 H4 Cl N O3 Pb | P b c n | 13.0104; 7.1278; 17.3503 90; 90; 90 | 1608.99 | Aboutorabi, Leila; Morsali, Ali Synthesis, crystal structures and reversible solid-state crystal-to-crystal transformation of three isostructural lead(ii) halide coordination polymers with different luminescence properties in bulk and nanoscale CrystEngComm, 2022, 24, 1049-1055 |
| 7244052 | CIF | C6 H4 I N O3 Pb | P b c n | 13.7536; 6.8778; 17.8671 90; 90; 90 | 1690.13 | Aboutorabi, Leila; Morsali, Ali Synthesis, crystal structures and reversible solid-state crystal-to-crystal transformation of three isostructural lead(ii) halide coordination polymers with different luminescence properties in bulk and nanoscale CrystEngComm, 2022, 24, 1049-1055 |
| 7244053 | CIF | C6 H4 Br N O3 Pb | P b c n | 13.2594; 7.0293; 17.5526 90; 90; 90 | 1635.98 | Aboutorabi, Leila; Morsali, Ali Synthesis, crystal structures and reversible solid-state crystal-to-crystal transformation of three isostructural lead(ii) halide coordination polymers with different luminescence properties in bulk and nanoscale CrystEngComm, 2022, 24, 1049-1055 |
| 7244055 | CIF | C30 H50 Cl2 Eu2 N2 O20 | P 3 2 1 | 19.4078; 19.4078; 23.1536 90; 90; 120 | 7552.69 | Dong, Yingling; Chen, Rui; Zhu, Xu; Niu, Caoyuan; Wu, Benlai; Yu, Ajuan Homochiral porous coordination polymer of EuIII for metal ion sensing and enantioselective adsorption CrystEngComm, 2022, 24, 1156-1160 |
| 7244056 | CIF | C25 H30 N6 O8 S4 | P 1 c 1 | 8.409; 16.64; 11.274 90; 101.37; 90 | 1546.6 | Hughes, David S.; Bingham, Ann L.; Hursthouse, Michael B.; Threlfall, Terry L.; Bond, Andrew D. The extensive solid-form landscape of sulfathiazole: geometrical similarity and interaction energies CrystEngComm, 2022, 24, 609-619 |
| 7244057 | CIF | C28 H34 N8 O4 S4 | P 1 21/n 1 | 8.523; 21.073; 9.087 90; 96.54; 90 | 1621.5 | Hughes, David S.; Bingham, Ann L.; Hursthouse, Michael B.; Threlfall, Terry L.; Bond, Andrew D. The extensive solid-form landscape of sulfathiazole: geometrical similarity and interaction energies CrystEngComm, 2022, 24, 609-619 |
| 7244058 | CIF | C26 H32 N6 O5 S4 | P 1 21/n 1 | 8.783; 14.728; 23.8 90; 98.46; 90 | 3045.2 | Hughes, David S.; Bingham, Ann L.; Hursthouse, Michael B.; Threlfall, Terry L.; Bond, Andrew D. The extensive solid-form landscape of sulfathiazole: geometrical similarity and interaction energies CrystEngComm, 2022, 24, 609-619 |
| 7244059 | CIF | C13 H15 N3 O4 S2 | P 1 21/c 1 | 8.636; 19.187; 9.354 90; 91.03; 90 | 1549.7 | Hughes, David S.; Bingham, Ann L.; Hursthouse, Michael B.; Threlfall, Terry L.; Bond, Andrew D. The extensive solid-form landscape of sulfathiazole: geometrical similarity and interaction energies CrystEngComm, 2022, 24, 609-619 |
| 7244060 | CIF | C24 H28 N6 O8 S4 | P 1 21/c 1 | 8.416; 17.394; 10.342 90; 104.7; 90 | 1464.4 | Hughes, David S.; Bingham, Ann L.; Hursthouse, Michael B.; Threlfall, Terry L.; Bond, Andrew D. The extensive solid-form landscape of sulfathiazole: geometrical similarity and interaction energies CrystEngComm, 2022, 24, 609-619 |
| 7244061 | CIF | C24 H26 N8 O4 S4 | P 1 21/c 1 | 8.154; 17.399; 10.077 90; 101.32; 90 | 1401.8 | Hughes, David S.; Bingham, Ann L.; Hursthouse, Michael B.; Threlfall, Terry L.; Bond, Andrew D. The extensive solid-form landscape of sulfathiazole: geometrical similarity and interaction energies CrystEngComm, 2022, 24, 609-619 |
| 7244062 | CIF | C21 H31 N5 O4 S2 | P 1 21/n 1 | 11.448; 14.224; 15.323 90; 111.6; 90 | 2319.9 | Hughes, David S.; Bingham, Ann L.; Hursthouse, Michael B.; Threlfall, Terry L.; Bond, Andrew D. The extensive solid-form landscape of sulfathiazole: geometrical similarity and interaction energies CrystEngComm, 2022, 24, 609-619 |
| 7244063 | CIF | C26 H30 N8 O4 S4 | P 1 21/n 1 | 8.01; 20.82; 8.99 90; 94.65; 90 | 1494.3 | Hughes, David S.; Bingham, Ann L.; Hursthouse, Michael B.; Threlfall, Terry L.; Bond, Andrew D. The extensive solid-form landscape of sulfathiazole: geometrical similarity and interaction energies CrystEngComm, 2022, 24, 609-619 |
| 7244064 | CIF | C15 H19 N3 O3 S2 | P 1 21/n 1 | 6.487; 12.332; 22.259 90; 94.19; 90 | 1775.9 | Hughes, David S.; Bingham, Ann L.; Hursthouse, Michael B.; Threlfall, Terry L.; Bond, Andrew D. The extensive solid-form landscape of sulfathiazole: geometrical similarity and interaction energies CrystEngComm, 2022, 24, 609-619 |
| 7244065 | CIF | C13 H16 N4 O2 S2 | P 1 21/n 1 | 8.2478; 21.0191; 9.0739 90; 96.534; 90 | 1562.85 | Hughes, David S.; Bingham, Ann L.; Hursthouse, Michael B.; Threlfall, Terry L.; Bond, Andrew D. The extensive solid-form landscape of sulfathiazole: geometrical similarity and interaction energies CrystEngComm, 2022, 24, 609-619 |
| 7244066 | CIF | C23 H28 N8 O5 S4 | P -1 | 8.051; 11.492; 15.552 77.45; 88.64; 88.64 | 1403.9 | Hughes, David S.; Bingham, Ann L.; Hursthouse, Michael B.; Threlfall, Terry L.; Bond, Andrew D. The extensive solid-form landscape of sulfathiazole: geometrical similarity and interaction energies CrystEngComm, 2022, 24, 609-619 |
| 7244067 | CIF | C13 H15 N3 O4 S2 | P 1 21/n 1 | 8.606; 21.643; 8.735 90; 98.76; 90 | 1608 | Hughes, David S.; Bingham, Ann L.; Hursthouse, Michael B.; Threlfall, Terry L.; Bond, Andrew D. The extensive solid-form landscape of sulfathiazole: geometrical similarity and interaction energies CrystEngComm, 2022, 24, 609-619 |
| 7244068 | CIF | C13 H17 N3 O4 S3 | P 1 21/n 1 | 6.036; 21.02; 12.791 90; 94.44; 90 | 1618 | Hughes, David S.; Bingham, Ann L.; Hursthouse, Michael B.; Threlfall, Terry L.; Bond, Andrew D. The extensive solid-form landscape of sulfathiazole: geometrical similarity and interaction energies CrystEngComm, 2022, 24, 609-619 |
| 7244069 | CIF | C16 H21 N3 O3 S2 | P 1 21/n 1 | 6.613; 12.074; 22.085 90; 93.44; 90 | 1760.2 | Hughes, David S.; Bingham, Ann L.; Hursthouse, Michael B.; Threlfall, Terry L.; Bond, Andrew D. The extensive solid-form landscape of sulfathiazole: geometrical similarity and interaction energies CrystEngComm, 2022, 24, 609-619 |
| 7244070 | CIF | C27 H32 N8 O4 S4 | P 1 21/n 1 | 8.363; 21.146; 9.116 90; 95.76; 90 | 1604 | Hughes, David S.; Bingham, Ann L.; Hursthouse, Michael B.; Threlfall, Terry L.; Bond, Andrew D. The extensive solid-form landscape of sulfathiazole: geometrical similarity and interaction energies CrystEngComm, 2022, 24, 609-619 |
| 7244071 | CIF | C14 H17 N5 O3 S2 | P 1 21/n 1 | 8.3551; 18.88; 10.7764 90; 96.79; 90 | 1688 | Hughes, David S.; Bingham, Ann L.; Hursthouse, Michael B.; Threlfall, Terry L.; Bond, Andrew D. The extensive solid-form landscape of sulfathiazole: geometrical similarity and interaction energies CrystEngComm, 2022, 24, 609-619 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!