Crystallography Open Database
Search results
Result: there are 64983 entries in the selection
Switch to the old layout of the pageDownload all results as: list of COD numbers | list of CIF URLs | data in CSV format
We are unable to provide that many records as a single archive.
You can instead download the entire COD archive as a single .zip, .tgz or .txz archive.
Searching space group like 'P 1 21/n 1'
COD ID ![]() |
Links | Formula ![]() |
Space group ![]() |
Cell parameters | Cell volume ![]() |
Bibliography |
|---|---|---|---|---|---|---|
| 8107211 | CIF | C15 H11 N O4 | P 1 21/n 1 | 8.0909; 24.4463; 12.698 90; 96.602; 90 | 2494.9 | Peng, Wei; Yang, Jicai; Yue, Yu; Deng, Xin; Jiang, Wujiu Crystal structure of methyl 2-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)acetate, C15H11NO4 Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 769-771 |
| 8107216 | CIF | C13 H9 Cl2 N3 O2 | P 1 21/n 1 | 7.918; 12.766; 13.767 90; 103.413; 90 | 1353.6 | Zhu, Jian-Liang; Liu, Xing-Hai The crystal structure of 2-chloro-N-((2-chlorophenyl)carbamoyl)nicotinamide, C13H9Cl2N3O2 Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 787-788 |
| 8107223 | CIF | C14 H12 N4 O3 S | P 1 21/n 1 | 12.2777; 9.4312; 12.9412 90; 107.945; 90 | 1425.61 | El-Emam, Ali A.; Al-Wahaibi, Lamya H.; Blacque, Olivier; Tiekink, Edward R. T. Crystal structure of 4-ethyl-2-{[(4-nitrophenyl)methyl]sulfanyl}-6-oxo-1,6-dihydropyrimidine-5-carbonitrile, C14H12N4O3S Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 811-814 |
| 8107235 | CIF | C23 H28 O3 | P 1 21/n 1 | 7.3985; 16.6978; 16.5137 90; 96.699; 90 | 2026.15 | Zhai, Pengda; Guan, Hui; Wang, Junna; Zhang, Yongkang; Wu, Haixia; Jia, Yifan; Li, Siye; Shan, Juchuan; Ding, Yue The crystal structure of methyl 4-((3,5-di-tert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)methyl) benzoate, C23H28O3 Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 857-859 |
| 8107236 | CIF | C9 H8 Ag N7 O3 | P 1 21/n 1 | 8.3179; 16.68; 9.0138 90; 103.839; 90 | 1214.3 | Yang, Jing; Wang, Xin-Ling; Du, Jun-Ya; Song, Ning Crystal structure of (poly[µ2-(1H-pyrazol-1-yl)methyl]-1H-benzotriazole-κ 2 N:N)-(nitrato-κ 2 O:O′) silver(I), C9H8AgN7O3 Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 861-863 |
| 8107238 | CIF | C14 H16 N6 Ni O8 | P 1 21/n 1 | 6.3975; 11.6712; 11.7199 90; 96.677; 90 | 869.15 | Hong, Deng-Feng; Li, Meng-Fei; Chu, Tian-Tian The crystal structure of diaqua-bis(pyrazolo[1,5-a]pyrimidine-3-carboxylato-κ2N,O)nickel(II) dihydrate, C14H16N6O8Ni Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 867-868 |
| 8107241 | CIF | C18 H16 O8 | P 1 21/n 1 | 14.5762; 6.6791; 17.424 90; 103.582; 90 | 1648.89 | Li, Yijv; Zhao, Nengwu; Ye, Jianghai; Xu, Fangfang; Luo, Shuntong; Lang, Tianqiong The crystal structure of Chrysosplenol D, C18H16O8 Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 877-879 |
| 8107260 | CIF | C18 H15 Br O2 | P 1 21/n 1 | 9.1704; 16.5309; 10.3528 90; 112.368; 90 | 1451.3 | Zhang, Yu-Long; Liu, Shu-Lian; Hou, Gui-Ge; Zhang, Xiao-Fan; Wang, Lei; Xin, Wen-Yu Crystal structure of (E)-7-bromo-2-(4-methoxybenzylidene)-3,4-dihydronaphthalen-1(2H)-one, C18H15BrO2 Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 945-947 |
| 8107263 | CIF | C36 H38 N2 O12 Ti2 | P 1 21/n 1 | 10.3151; 15.8747; 11.502 90; 98.471; 90 | 1862.9 | Youzhu, Yu; Hui, Wang; Leilei, Li; Yuhua, Guo; Jing, Feng; Yichao, Li Crystal structure of bis(μ2-2-oxido-2-phenylacetato-κ3 O,O′:O′)-bis(N-oxido-benzamide-κ2 O,O′)-bis(propan-2-olato-κ1 O)dititanium(IV), C36H38N2O12Ti2 Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 957-959 |
| 8107265 | CIF | C34 H76 N4 O16 Ti4 | P 1 21/n 1 | 10.0452; 16.9053; 14.6374 90; 108.029; 90 | 2363.6 | Youzhu, Yu; Hui, Wang; Leilei, Li; Yuhua, Guo; Qianqian, Fu; Jingtao, Dai Crystal structure of bis((N-methyl-2-oxyethyl)amine)-bis(μ 2-N,N,N-tris(2-oxoethyl)amine)-bis(isopropoxy)-bis(μ 3-oxo)tetratitanium(IV)– isopropanol (1/2), C34H76N4O16Ti4 Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 965-967 |
| 8107268 | CIF | C22 H26 Mn N6 O8 | P 1 21/n 1 | 11.1483; 10.5789; 11.8538 90; 115.883; 90 | 1257.76 | Xia, Yu-Pei; Han, Lu-Lu Crystal structure of dimethylammonium poly[μ4-1,1′-(1,4- phenylenebis(methylene))bis(1H-pyrazole-3,5-dicarboxylato-κ6 N,O:O′:N′,O″:O‴) manganese(II)], C22H26MnN6O8 Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 975-976 |
| 8107285 | CIF | C18 H20 Cl N O5 S | P 1 21/n 1 | 5.671; 18.225; 17.99 90; 90.18; 90 | 1859 | Li, Yong; Wu, Yundeng; Wang, Jingjing The crystal structure of 3-((4-chloro-N-(2-methoxyethyl)benzamido)methyl)phenyl methanesulfonate, C18H20ClNO5S Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 1033-1036 |
| 8107287 | CIF | C14 H12 N6 O6 Zn | P 1 21/n 1 | 7.0347; 12.8467; 9.0017 90; 112.525; 90 | 751.45 | Kong, Yang; Wang, Chang-Zhao The crystal structure of diaqua-bis(pyrazolo[1,5-a]-pyrimidine-3-carboxylato-κ2 N,O)zinc(II), C14H12N6O6Zn Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 1041-1042 |
| 8107300 | CIF | C14 H12 F3 N O3 | P 1 21/n 1 | 14.4583; 6.6553; 14.8395 90; 113.733; 90 | 1307.16 | Wang, Jingjing; Wu, Yundeng; Li, Yong The crystal structure of ethyl 2,3,5-trifluoro-4-(4-oxo-3,4-dihydropyridin-1(2H)-yl)benzoate, C14H12F3NO3 Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 1087-1089 |
| 8107304 | CIF | C19 H16 Br2 Cl2 Cu N2 O2 | P 1 21/n 1 | 12.4679; 8.6176; 19.7854 90; 97.161; 90 | 2109.23 | Wu, Qiong; Yu, Guojun; Yang, Jiao; Yang, Qiuling {6,6′-((1E,1′E)-((2,2-dimethylpropane-1,3-diyl)bis(azaneylylidene))bis(methaneylylidene))bis(2-bromo-4-chlorophenolate)-κ4N,N′,O,O′}copper(II), C19H16Br2Cl2CuN2O2 Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 1101-1103 |
| 8107309 | CIF | C13 H9 Cl N2 O4 | P 1 21/n 1 | 11.1882; 8.0672; 14.0813 90; 94.084; 90 | 1267.7 | Zhang, Zhijian; Xiao, Xiyuan; Jiang, Wujiu; Feng, Hao The crystal structure of (Z)-6-(((5-chloro-2-hydroxyphenyl)amino)methylene)- 4-nitrocyclohexa, C13H9ClN2O4 Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 1119-1120 |
| 8107311 | CIF | C9 H9 Br O3 | P 1 21/n 1 | 10.8914; 4.6335; 18.4554 90; 97.278; 90 | 923.85 | Gao, Dongmei; Zuo, Zhenyu The crystal structure of 4-(2-bromoethoxy)-2-hydroxybenzaldehyde, C9H9BrO3 Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 1125-1126 |
| 8107318 | CIF | C22 H28 O S | P 1 21/n 1 | 6.7729; 17.3973; 16.6277 90; 92.38; 90 | 1957.55 | Bai, Xiaofan; Zhang, Ziwen; Guo, Wei; Zhang, Yongkang; Zhang, Liqiang; Liu, Huihui; Wu, Haixia; Li, Yong The crystal structure of 2,6-di-tert-butyl-4-(4-(methylthio)benzylidene)cyclohexa-2,5-dien-1-one, C22H28OS Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 1143-1145 |
| 8107325 | CIF | C39 H45 N5 O3 | P 1 21/n 1 | 11.8558; 12.1159; 24.014 90; 94.812; 90 | 3437.3 | Zhou, Ji; Yuan, Shuhao; Yan, Shiyu; Tang, Qingyuan; Mao, Han; He, Qian; Cui, Ying The crystal structure of (E)-3′,6′-bis(diethylamino)-2-((5-(diethylamino)-2-hydroxybenzylidene)amino)spiro[isoindoline-1,9′-xanthen]-3-one, C39H45N5O3 Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 1167-1170 |
| 8107330 | CIF | C21 H16 O4 | P 1 21/n 1 | 13.531; 8.39; 14.288 90; 95.322; 90 | 1615.1 | Shin, Soon Young; Ahn, Seunghyun; Koh, Dongsoo The crystal structure of (Z)-2-(2,3-dimethoxybenzylidene)naphtho[1,2-b]furan-3(2H)-one, C21H16O4 Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 1189-1191 |
| 8107337 | CIF | C17 H16 I2 N4 O Zn | P 1 21/n 1 | 7.4827; 14.9521; 18.2838 90; 99.251; 90 | 2019 | Li, Ben; Huang, Yujiao; Qian, Weicheng; Pang, Haixia; Tang, Qiang Crystal structure of catena-poly[diiodido-(μ2-1,5-dimethyl-2-phenyl-4-((pyridin-4- ylmethylene)amino)-1,2-dihydro-3H -pyrazol-3-one-κ2 N: O)zinc(II)], C17H16I2N4OZn Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 5-7 |
| 8107341 | CIF | C27 H40 N2 O6 S | P 1 21/n 1 | 11.2654; 21.63; 12.2868 90; 111.422; 90 | 2787.1 | Zhao, Wen-Ze Crystal structure of (E)-3-(2-(4-(diethylamino)-2-hydroxystyryl)-3,3-dimethyl-3H-indol-1-ium-1-yl)propane-1-sulfonate – methanol (1/2), C25H32N2O4S⋅2CH3OH Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 19-21 |
| 8107345 | CIF | C13 H10 N4 O7 | P 1 21/n 1 | 10.7017; 7.124; 19.0878 90; 99.28; 90 | 1436.19 | Jiang, Cheng-Jun; Cheng, Die; Xia, Ying-Fan; Zhang, Jia-rong; Lin, Shu-ting The crystal structure of 3-nitrobenzene-1,2-dicarboxylic acid—pyrazine-2-carboxamide(1/1), C13H10N4O7 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 35-37 |
| 8107349 | CIF | C20 H17 I N4 | P 1 21/n 1 | 7.304; 14.83; 16.482 90; 98.202; 90 | 1767 | Lee, Hon Man; Hung, Hsiu-Yu The crystal structure of 3-anilino-1,4-diphenyl-4H-1,2,4-triazol-1-ium iodide, C20H17N4I Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 49-50 |
| 8107354 | CIF | C20 H24 N2 O8 | P 1 21/n 1 | 3.8981; 16.0675; 16.2908 90; 94.537; 90 | 1017.14 | Xia, Ying-Fan; Lin, Shu-Ting; Zhang, Jia-Rong; Jiang, Cheng-Jun The crystal structure of oxalic acid – 2-ethoxybenzamide (2/1), C20H24N2O8 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 65-67 |
| 8107358 | CIF | C20 H13 Cd Cl N2 O5 | P 1 21/n 1 | 11.4994; 13.1171; 13.0233 90; 109.126; 90 | 1856 | Huang, Guang The crystal structure of poly[(1,10-phenanthroline-κ2 N,N′)-(μ 4-2-chlorobenzene-1,3-dicarboxylato-κ5 O:O′:O″:O‴) cadmium(II)] monohydrate, C20H13CdClN2O5 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 79-81 |
| 8107364 | CIF | C48 H56 N4 O6 | P 1 21/n 1 | 12.8878; 27.5641; 13.0517 90; 111.908; 90 | 4301.7 | Chen, Qing-Gang; Wan, Wei; Peng, Guo-Ying; Huang, Chang-gan Crystal structure of S-2-(1-(5-methylpyridin-2-ylamino)octyl)-3-hydroxynaphthalene-1,4-dione, C24H28N2O3 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 101-103 |
| 8107365 | CIF | C76 H65 Cl2 N13 Ni3 O9 | P 1 21/n 1 | 15.937; 16.805; 27.463 90; 94.613; 90 | 7331 | Zhongyuan, Zhou; Liguo, Yang; Kun, Zou; Jiaqi, Fu; Xinyu, Ji Crystal structure of bis(μ2-5-chloro-2-oxido-N-(1-oxido-2-oxo-2-phenylethylidene)-benzohydrazonato-κ5 N,O,O′:N′,O′′)-oktakis(pyridine-κ1 N)trinickel(II) – methanol – pyridine (1/1/1) C76H65N13Cl2Ni3O9 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 105-108 |
| 8107379 | CIF | C17 H13 Cl F4 O3 S | P 1 21/n 1 | 17.0097; 4.4625; 22.952 90; 102.933; 90 | 1698 | Liu, Dongdong; Zhang, Lixin; Zhang, Jing The crystal structure of methyl 2-((4-chloro-2-fluoro-6-((2,2,2-trifluoroethyl) thio)phenoxy)methyl)benzoate, C17H13ClF4O3S Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 153-155 |
| 8107392 | CIF | C19 H12 Cl F2 N5 O2 | P 1 21/n 1 | 14.405; 7.579; 17.61 90; 95.856; 90 | 1913 | Li, Nan; Li, Zheng; Wang, Tian Ci; Miao, Jun; Wu, Haixia; Gao, Jin Long; Shan, Ju Chuan Crystal structure of N-2,6-difluorobenzoyl-N′-[1-(3-chloro-4-methyl-phenyl)-4-cyano-1H-pyrazol-5-carbamoyl]urea, C19H12ClF2N5O2 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 193-195 |
| 8107397 | CIF | C14 H16 Co N6 O8 | P 1 21/n 1 | 6.352; 11.7438; 11.788 90; 96.562; 90 | 873.58 | Hong, Dong-Feng; Guo, Ao; Kou, Xian-Ke The crystal structure of diaqua-bis(pyrazolo[1,5-a]pyrimidine-3-carboxylato-κ2 N,O)-cobalt(II) dihydrate, C14H16N6O8Co Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 211-213 |
| 8107402 | CIF | C15 H14 Cl N3 O2 | P 1 21/n 1 | 15.812; 8.82; 22.615 90; 109.814; 90 | 2967.2 | Wang, Yi-Ning; Min, Li-Jing; Han, Liang; Liu, Xing-Hai; Sun, Guo-Xiang Hydrogen bonded dimers in the crystal structure of 2-chloro-N-((3,5-dimethylphenyl)carbamoyl)-nicotinamide, C30H28Cl2N6O4 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 227-229 |
| 8107422 | CIF | C17 H12 I N O3 | P 1 21/n 1 | 7.5319; 7.9745; 25.1313 90; 98.459; 90 | 1493.04 | Sun, Yi-Fan; Tang, Qian-Qian; Zhang, Yue; Yang, Fan; Liu, Yong-Jun; Cong, Wei Crystal structure of 1-(2-iodobenzoyl)-6-methoxy-1H-indole-3-carbaldehyde, C17H12INO3 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 299-301 |
| 8107424 | CIF | C22 H28 N2 O2 | P 1 21/n 1 | 6.463; 14.889; 10.282 90; 95.105; 90 | 985.5 | Xiao, Zhenxiu; Deng, Xin; Jiang, Wujiu; Fu, Weiwei The crystal structure of 6,6′-((1E,1′E)-hydrazine-1,2-diylidenebis(methanylylidene)) bis(2-(tert-butyl)phenol), C22H28N2O2 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 305-307 |
| 8107430 | CIF | C34 H36 Cu N2 O4 | P 1 21/n 1 | 15.4951; 5.6273; 17.3541 90; 90.831; 90 | 1513.04 | Moon, Sunhwa; Shin, Jiehye; Ok, Kang Min; Do, Junghwan Crystal structure of bis(benzylamine-κ1 N)-bis((E)-2-methyl-3-phenylacrylato-κ1 O)copper(II), C34H36CuN2O4 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 327-329 |
| 8107438 | CIF | C42 H46 Br2 N2 O8 | P 1 21/n 1 | 7.5393; 10.7586; 24.073 90; 91.275; 90 | 1952.1 | Yu, Xuewen Crystal structure of bis(6-carboxyhexyl)-4,4′-bipyridinium dibromide – 2,6-dihydroxynaphthalene (1/2), C42H46Br2N2O8 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 353-354 |
| 8107450 | CIF | C17 H16 Cl5 N O3 Sn | P 1 21/n 1 | 11.1341; 10.5867; 18.6979 90; 93.126; 90 | 2200.71 | Böhme, Uwe; Weling, Gisela The crystal structure of trichlorido[N-[(2-oxyphenyl)methylidene]phenylglycinemethylester-κ3 O,N,O′]-tin(IV) – methylene chloride (1/1), C16H14Cl3NO3Sn·CH2Cl2 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 391-393 |
| 8107451 | CIF | C18 H14 Cl2 O3 | P 1 21/n 1 | 10.3048; 8.962; 18.0909 90; 93.046; 90 | 1668.36 | Yang, Yanliang; Li, Yadi The crystal structure of furan-2,5-diylbis((4-chlorophenyl)methanol), C18H14Cl2O3 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 395-397 |
| 8107475 | CIF | C27 H44 N4 O7 S | P 1 21/n 1 | 10.216; 18.133; 17.036 90; 98.371; 90 | 3122.2 | Lin, Na; Sun, Ruiqin; Li, Xiaofang Crystal structure of tetrapropylammonium guanidinium 4,4′-sulfonyldibenzoate monohydrate, C27H44N4O7S Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 487-489 |
| 8107476 | CIF | C18 H40 N5 O4 S | P 1 21/n 1 | 8.4254; 17.9168; 16.147 90; 98.302; 90 | 2411.9 | Li, Mengfei; Geng, Fangfang; Zhu, Honglei Crystal structure of bis(tetrapropylammonium) terephthalate – 1-(diaminomethylene)thiourea – water (1/2/4) C18H40N5O4S Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 491-493 |
| 8107486 | CIF | C18 H24 N6 O6 Zn | P 1 21/n 1 | 10.1669; 8.0831; 13.1012 90; 91.221; 90 | 1076.41 | Hong, Dong-feng; Ye, Jia-Qi; Guo, Wen-Bo Crystal structure of bis(6-aminopyridine-2-carboxylato–k2O,N)-bis(N,N-dimethylformamide-k1 O)zinc(II), C18H24N6O6Zn Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 529-531 |
| 8107511 | CIF | C23 H17 Cu N3 O5 | P 1 21/n 1 | 11.4951; 8.6966; 21.1454 90; 105.433; 90 | 2037.65 | Zeng-Bing, Zhao; Xue-Ping, Li; Shu-Cheng, Yang; Bing-Qi, Yang; Ze-Tao, Wang; Lan-Xing, Cheng; Xi-Shi, Tai The crystal structure of [(2,2′-bipyridine-6-carboxylato-κ3 N,N,O)-(6-phenylpyridine-2-carboxylate-κ2 N,O)copper(II)] monohydrate, C23H17N3O5Cu Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 615-617 |
| 8107512 | CIF | C47 H37 Fe2 N O4 P2 Se2 | P 1 21/n 1 | 12.8144; 17.9714; 19.1077 90; 104.329; 90 | 4263.5 | Bai, Shu-Fen; Lü, Shuang; Li, Qian-Li Crystal structure of bis(μ-benzeneselenolato)-(μ-[N-benzyl-N-(diphenylphosphanyl)-P,P-diphenylphosphinous amide])-tetracarbonyl diiron (Fe–Fe), C47H37Fe2NO4P2Se2 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 619-621 |
| 8107517 | CIF | C16 H17 N3 O | P 1 21/n 1 | 8.2818; 17.0495; 10.2429 90; 98.98; 90 | 1428.58 | Qiao, Ai-Li; Guo, Zheng-Feng The crystal structure of (Z)-4-amino-N′-(1-(o-tolyl)ethylidene)benzohydrazide, C16H17N3O Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 639-640 |
| 8107520 | CIF | C19 H20 N4 O6 Zn | P 1 21/n 1 | 11.7411; 13.7831; 13.5425 90; 97.564; 90 | 2172.5 | Guo, Ya-Fei; Chen, Bao-Kuan The crystal structure of catena-poly[bis(1-ethylimidazole-k1 N)-(μ 2-benzene-1-carboxyl-3,5-dicarboxylato-κ 2 O, O′)zinc(II)], C19H20N4O6Zn Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 649-651 |
| 8107525 | CIF | C13 H7 Br N3 O6 Re | P 1 21/n 1 | 7.2645; 10.0607; 20.7717 90; 97.18; 90 | 1506.22 | Mkhatshwa, Marcus; Malan, Frederick P.; Makgopa, Katlego; Manicum, Amanda-Lee E. The crystal structure of fac-tricarbonyl(6-bromo-2,2-bipyridine-κ2 N,N)-(nitrato-κO)rhenium(I), C13H7BrN3O6Re Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 667-669 |
| 8107526 | CIF | C19 H18 N2 O4 | P 1 21/n 1 | 8.375; 22.018; 9.237 90; 106.271; 90 | 1635.1 | Zhang, Sheng-Ting; Zou, Fei; Lai, Ni; Yuan, Lin; Li, Zhong-Yan The crystal structure of (E)-N′-(4-hydroxy-3-methoxybenzylidene)-2-naphthohydrazide monohydrate, C19H18N2O4 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 671-672 |
| 8107544 | CIF | C11 H12 Br N O2 | P 1 21/n 1 | 7.5143; 11.8968; 12.9852 90; 105.575; 90 | 1118.2 | Dong, Zhang-Chao; Zheng, Liang-Liang; Pan, Bo-Wen; Shi, Yang; Zhou, Ying Synthesis and crystal structure (E)-1-(4-bromo-2-hydroxyphenyl)-3-(dimethylamino)prop-2-en-1-one, C11H12BrNO2 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 733-734 |
| 8107548 | CIF | C17 H10 F N S | P 1 21/n 1 | 6.1859; 10.7071; 19.4475 90; 95.794; 90 | 1281.49 | Zhu, Xiaoming; Jin, Hongsheng The crystal structure of 2-(2-fluorophenyl)naphtho[2,1-d]thiazole, C17H10FNS Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 745-746 |
| 8107551 | CIF | C14 H4 O2 S4 | P 1 21/n 1 | 3.8518; 8.9728; 18.0073 90; 93.554; 90 | 621.16 | Jia, Yan; Yu, Pengling; Li, Shihui; Zhao, Yumei; Zheng, Xiaoxin Crystal structure of dithieno[2,3-d:2′,3′-d′]benzo[1,2-b:4,5-b′]dithiophene-5,10-dione, C14H4O2S4 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 751-752 |
| 8107554 | CIF | C18 H19 Br N2 Ni O8 | P 1 21/n 1 | 16.7861; 7.0732; 17.1041 90; 102.674; 90 | 1981.31 | Shi, Zhen-Zhen; Chen, Jun-Ling Crystal structure of triaqua-(5-bromoisophthalato-κ1 O)-(2,2′-bipyridine-κ2 N:N′)nickel(II) hydrate, C18H19BrN2NiO8 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 759-761 |
| 8107576 | CIF | C26 H30 Cd2 I4 N10 | P 1 21/n 1 | 8.1164; 15.9401; 13.5531 90; 96.067; 90 | 1743.6 | Yang, Hai-Yan; Wang, Hong-Fang; Li, Hui; Li, Ying-Hua; Zhao, Yao-Min Crystal structure of cyclo[tetraiodido-bis{μ2-1-[(benzotriazol-1-yl)methyl]-1-H-1,3-(2-isopropyl-imidazol)-k 2N:N}dicadmiun(II)], C26H30N10Cd2I4 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 835-836 |
| 8107577 | CIF | C26 H24 N2 O2 | P 1 21/n 1 | 10.949; 9.93; 20.125 90; 98.51; 90 | 2164 | Da, Weihao; Kong, Haonan; Wang, Ruiyao; Lin, Yi The crystal structure of tert-butyl (E)-3-(2-(benzylideneamino)phenyl)-1H-indole-1-carboxylate, C26H24N2O2 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 837-839 |
| 8107583 | CIF | C18 H27 N5 O6 | P 1 21/n 1 | 11.6588; 7.0645; 25.7 90; 94.899; 90 | 2109 | Wang, Xue; Han, Jie; Zheng, Jing; Yuan, Xiao-Jing; Xiong, Ying Crystal structure of (E)-2-amino-N′-((3-hydroxy-5-(hydroxymethyl)-2-methylpyridin-4-yl)methylene)benzohydrazide – dimethylformamide – water (1/1/2), C15H16N4O3·C3H7NO·2H2O Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 861-862 |
| 8107596 | CIF | C17 H18 F6 N6 O | P 1 21/n 1 | 9.9491; 18.1523; 11.7703 90; 113.473; 90 | 1949.8 | Pan, Nian-Juan; Yan, Chang; Fei, Qiang; Wu, Wen-Neng Crystal structure of (1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl)(4-((2-methyl-6-(trifluoromethyl)pyrimidin-4-yl)amino)piperidin-1-yl)methanone, C17H18F6N6O Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 903-905 |
| 8107627 | CIF | C18 H20 F4 N6 O4 | P 1 21/n 1 | 6.149; 11.0063; 14.0214 90; 94.386; 90 | 946.16 | Fujisawa, Kiyoshi; Harakuni, Seigo; Ageishi, Keigo; Tiekink, Edward R. T. Crystal structure of bis(3,5-dimethyl-1H-pyrazol-4-ammonium) tetrafluoroterephthate, 2[C5H10N3][C8F4O4] Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 1017-1020 |
| 8107636 | CIF | C9 H10 N2 O S2 | P 1 21/n 1 | 4.0727; 22.256; 11.4854 90; 98.364; 90 | 1029.99 | Madanhire, Tatenda; Abrahams, Abubak'r; Hosten, Eric C.; Betz, Richard Crystal structure of (E)-2-[(ortho-hydroxy)benzylidene]-2-(thiomethyl)- thionohydrazide, C9H10N2OS2 Zeitschrift für Kristallographie - New Crystal Structures, 2015, 230, 13-14 |
| 8107638 | CIF | C16 H16 Cu N2 S4 | P 1 21/n 1 | 7.6067; 6.5835; 18.5042 90; 97.29; 90 | 919.18 | Onwudiwe, Damian C.; Strydom, Christien A.; Hosten, Eric C. Redetermination of the crystal structure of bis(N-methyl-N-phenyldithiocarbamato- κ2S,S’)copper(II), C16H16CuN2S4 Zeitschrift für Kristallographie - New Crystal Structures, 2015, 230, 17-18 |
| 8107651 | CIF | C22 H26 N6 Ni O8 | P 1 21/n 1 | 10.9372; 10.4567; 11.7618 90; 116.555; 90 | 1203.25 | Li, Fenfang Crystal structure of bis(dimethylammonium) poly[(μ4-1,1′-(1,4-phenylenebis(methylene))bis(1H-pyrazole-3,5-dicarboxylato))-κ6 O 1, N 2:O 2:O 3:O 1′,N 2′]nickel (II)], C22H26N6NiO8 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 1027-1029 |
| 8107654 | CIF | C54 H34 Mn3 N4 O12 S6 | P 1 21/n 1 | 11.014; 22.3222; 11.2886 90; 105.436; 90 | 2675.27 | Zhou, Lili; Zhang, Zhongyu; Men, Xiaoxia; Zhang, Yaxuan The crystal structure of hexakis(3-thiophenecarboxylato-κ 2 O,O″)-bis(1,10-phenanthroline-κ 2 N,N′) trimanganese(II), C54H34N4O12S6Mn3 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 1039-1041 |
| 8107659 | CIF | C7 H6 Cu I N O6 | P 1 21/n 1 | 9.7229; 5.1728; 20.8336 90; 97.636; 90 | 1038.53 | Kong, Yang; Lu, ChenFei; Wang, Chang-Zhao; Tian, Bin; Dang, YiXuan; Han, ZiHao The crystal structure of catena-poly[aqua-(4-iodopyridine-2,6-dicarboxylato-κ 3 N,O,O ′)-copper(II)] monohydrate, C7H6NO6ICu Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 1057-1059 |
| 8107663 | CIF | C21 H24 Cd N4 O5 | P 1 21/n 1 | 9.5381; 20.9393; 11.4813 90; 104.366; 90 | 2221.4 | Cai, Jin; Yao, Xin-Tong; Chen, Man-Sheng Crystal structure of poly[(μ 2-5-hydroxy-isophthalato-κ4 O,O′:O″,O‴)-(μ 2-1,5-bis(imidazol-2-methyl)pentane-κ2 N:N′)cadmium(II)], C21H24CdN4O5 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 1071-1073 |
| 8107671 | CIF | C16 H11 N O2 | P 1 21/n 1 | 3.7617; 12.9267; 23.4609 90; 92.337; 90 | 1139.87 | Elmakki, Mohammed A.; Taoana, Thato N.; Jacobs, Frederick J. F.; Venter, Johan A. The crystal structure of 2-anilino-1,4-naphthoquinone, C10H11NO2 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 1101-1102 |
| 8107673 | CIF | C17 H14 Cl2 N2 O2 | P 1 21/n 1 | 8.4863; 12.654; 15.088 90; 103.612; 90 | 1574.7 | Zhao, Meimei; Du, Mo; Liu, Bin Crystal structure of ethyl 2-((2,6-dichloro-4-(cyanomethyl)phenyl) amino)benzoate, C17H14Cl2N2O2 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 1105-1106 |
| 8107674 | CIF | C17 H13 N O3 | P 1 21/n 1 | 9.5306; 6.1971; 23.3849 90; 101.445; 90 | 1353.7 | Shi, Ju-Mei; Hao, Yong-Jia; Xu, Lian-Hua; Zhou, Ying; Wang, Hua-Bin Synthesis and crystal structure of 2-(3-oxo-3-phenylpropyl)isoindoline-1,3-dione, C17H13NO3 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 1107-1108 |
| 8107675 | CIF | C16 H9 F4 N O4 Rh | P 1 21/n 1 | 9.282; 11.3364; 16.0352 90; 105.933; 90 | 1622.48 | Zhong, Zihao; Meng, Miao The crystal structure of bis(acetonitrile-κ1N)tetrakis(μ2-2,6-difluorobenzoato-κ2O:O′)rhodium(II) (Rh–Rh), C32H18F8O8N2Rh2 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 1109-1111 |
| 8107678 | CIF | C23 H19 N O7 | P 1 21/n 1 | 17.9964; 5.9211; 18.8608 90; 98.201; 90 | 1989.23 | Chakraborty, Bimal Bhushan; Paul, Saurav; Anwar, Siddique; Choudhury, Sudip The crystal structure of ethyl 4-hydroxy-2-(4-methoxyphenyl)-5-oxo-1-(2-oxo-2H-chromen-6-yl)-2,5-dihydro-1H-pyrrole-3-carboxylate, C23H19NO7 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 1119-1121 |
| 8107683 | CIF | C12 H32 Cl4 Cu2 O10 | P 1 21/n 1 | 9.0202; 9.5791; 13.6994 90; 92.555; 90 | 1182.53 | Liu, Zhaolong; Jin, Shifeng The crystal structure of 18-crown-6 ― tetraaqua-dichlorido-di-μ2-chloridodicopper(II) (2/1), C12H32O10Cu2Cl4 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 1135-1136 |
| 8107687 | CIF | C16 H26 Cl2 Co N2 O14 S2 | P 1 21/n 1 | 5.3261; 39.755; 6.2518 90; 96.88; 90 | 1314.22 | Liu, Zheng-Jun; Chen, Xiao-Miao; Wu, Qiang; Zhang, Yu-Tao; Zhou, Wu-Chao; Wei, Li; Zhao, Ying-Xian Crystal structure of tetraaqua-bis(((4-chlorophenyl)sulfonyl)glycinato-κO)cobalt(II) dihydrate, C16H26Cl2CoN2O14S2 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 1149-1151 |
| 8107689 | CIF | C19 H16 F4 O3 | P 1 21/n 1 | 9.5792; 9.5542; 17.6986 90; 99.508; 90 | 1597.55 | Li, Yu-Lun; Meng, Qing-Guo; Hou, Gui-Ge; Geng, Zi-Kai Crystal structure of 2-((2-fluoro-4-(trifluoromethyl)phenyl)(hydroxy)methyl)-7-methoxy-3,4-dihydronaphthalen-1((2H))-one, C19H16F4O3 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 1157-1159 |
| 8107694 | CIF | C44 H52 N4 O12 | P 1 21/n 1 | 8.0478; 9.8093; 13.1602 90; 104.712; 90 | 1004.85 | Tong, Hongjuan; Xu, Xiaona; Zhu, Zhoujing; Liu, Bin Crystal structure of N-cyclopropyl-3-hydroxy-4-methoxybenzamide, C11H13NO3 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 1175-1176 |
| 8107699 | CIF | C12 H16 Br2 O4 | P 1 21/n 1 | 12.594; 4.4613; 12.878 90; 91.209; 90 | 723.4 | Wang, Zhi-Yong; Lu, Wan-Li; Zhou, Xu; Yang, Xian-Jiong; Zhang, Qi-Long; Xu, Hong Crystal structure of 1,4-dibromo-2,5-bis(2-methoxyethoxy)benzene-1,4-diol, C12H16Br2O4 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 1193-1194 |
| 8107704 | CIF | C24 H14 Cl0 N2 S | P 1 21/n 1 | 18.443; 4.0161; 23.396 90; 99.246; 90 | 1710.4 | Shen, Lingyi; Gong, Qianjin; Xu, Na; Xu, Xiaoling; Jiang, Mengna; Zhao, Jiang; Huang, Ya-Li; Wang, Zhi-Yong; Zhang, Qi-Long Crystal structure of (E)-1-(benzo[d]thiazol-2-yl)-N-(4,5-dihydropyren-2-yl)methanimine, C24H16N2S Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 1209-1210 |
| 8107711 | CIF | C22 H14 Cl2 F4 N2 Pt | P 1 21/n 1 | 16.858; 14.876; 17.125 90; 98.552; 90 | 4247 | Cheng, Chen-En-Ze; Zhang, Jian-Guo; Tan, Wei; Zou, Hao Crystal structure of dichlorido-bis[2-(2,4-difluorophenyl)pyridine-κ 1N]platinum(II), C22H14Cl2F4N2Pt Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 1233-1235 |
| 8107714 | CIF | C24 H28 Cl N4 O3 Re | P 1 21/n 1 | 9.9185; 27.256; 10.0375 90; 109.082; 90 | 2564.42 | Schmitt, Bonell; Gerber, Thomas I. A.; Hosten, Eric C.; Betz, Richard Crystal structure of fac-tricarbonyl-chlorido-bis(para-N’,N’-dimethyl-κ- N-pyridyl)rhenium(I) toluene (1:1), C24H28ClN4O3Re Zeitschrift für Kristallographie - New Crystal Structures, 2015, 230, 56-58 |
| 8107719 | CIF | C10 H12 Br N3 S | P 1 21/n 1 | 8.561; 11.012; 13.214 90; 107.345; 90 | 1189.09 | Madanhire, Tatenda; Abrahams, Abubak'r; Hosten, Eric C.; Betz, Richard Crystal structure of 4-(4-bromophenyl)-1-(propan-2-ylidene)thiosemicarbazide, C10H12BrN3S Zeitschrift für Kristallographie - New Crystal Structures, 2015, 230, 67-68 |
| 9000050 | CIF | As2 O3 | P 1 21/n 1 | 5.25; 12.87; 4.54 90; 93.82; 90 | 306.075 | Frueh, A. J. The crystal structure of claudetite (monoclinic As2O3) American Mineralogist, 1951, 36, 833-850 |
| 9000140 | CIF | Fe H4 O6 P | P 1 21/n 1 | 5.3; 9.77; 8.73 90; 90.6; 90 | 452.023 | Moore, P. B. The crystal structure of metastrengite and its relationship to strengite and phosphophyllite American Mineralogist, 1966, 51, 168-176 |
| 9000148 | CIF | Ca0.32 Ce0.15 La0.14 O4 P0.96 Pb0.01 Si0.04 Th0.33 U0.05 | P 1 21/n 1 | 6.717; 6.92; 6.434 90; 103.83; 90 | 290.393 | Finney, J. J.; Rao, N. N. The crystal structure of cheralite American Mineralogist, 1967, 52, 13-19 |
| 9000253 | CIF | Ag2 S | P 1 21/n 1 | 4.229; 6.931; 7.862 90; 99.61; 90 | 227.211 | Wiegers, G. A. The crystal structure of the low-temperature form of silver selenide American Mineralogist, 1971, 56, 1882-1888 |
| 9000265 | CIF | Fe2 H5 K O11 P2 | P 1 21/n 1 | 9.782; 9.658; 9.751 90; 102.24; 90 | 900.28 | Moore, P. B. Octahedral tetramer in the crystal structure of leucophosphite, K2[Fe4(OH)2(H2O)2(PO4)4].2H2O American Mineralogist, 1972, 57, 397-410 |
| 9000313 | CIF | Fe2 H14.5 O19.25 S3 | P 1 21/n 1 | 14.3; 20.12; 5.425 90; 96.8; 90 | 1549.88 | Robinson, P. D.; Fang, J. H. Crystal structures and mineral chemistry of hydrated ferric sulphates. III. The crystal structure of kornelite American Mineralogist, 1973, 58, 535-539 |
| 9000388 | CIF | Al1.5 Ca0.5 Fe4 Mg0.5 Mn0.5 Na2.31 O24 P6 | P 1 21/n 1 | 11.868; 12.382; 6.354 90; 114.52; 90 | 849.512 | Moore, P. B.; Molin-Case J Contribution to pegmatite phosphate giant crystal paragenesis: II. The crystal chemistry of wyllieite, Na2Fe2Al[PO4]3, a primary phase American Mineralogist, 1974, 59, 280-290 |
| 9000679 | CIF | Li0.6 O4 Si1.3 Zn1.1 | P 1 21/n 1 | 6.34; 10.516; 5.011 90; 90.5; 90 | 334.078 | Yu, S. C.; Smith, D. K.; Austerman, S. B. The crystal structures and the phase transformation of Zn-Li silicates T = room temperature American Mineralogist, 1978, 63, 1241-1248 |
| 9000988 | CIF | Fe3 H12 O20 P4 | P 1 21/n 1 | 5.152; 16.629; 8.749 90; 90.8; 90 | 749.477 | Vencato, I.; Mascarenhas, Y. P.; Mattievich, E. The crystal structure of FeFe2(PO3OH)4(H2O)4: a new synthetic compound of mineralogic interest American Mineralogist, 1986, 71, 222-226 |
| 9001050 | CIF | K Na1.41 O23.13 Si8 Y | P 1 21/n 1 | 9.512; 23.956; 9.617 90; 93.85; 90 | 2186.48 | Ghose, S.; Sen Gupta, P. K.; Campana, C. F. Symmetry and crystal structure of monteregianite, Na4K2Y2Si16O38.10H2O, a double-sheet silicate with zeolitic properties Note: Several bond lengths cannot be reproduced with this data, but the authors no longer have the original data, so they cannot check American Mineralogist, 1987, 72, 365-374 |
| 9001286 | CIF | Ca2 Ge1.255 O7 Si0.745 Zn | P 1 21/n 1 | 9.112; 7.9; 9.38 90; 114.03; 90 | 616.698 | Armbruster, T.; Rothlisberger, F.; Seifert, F. Layer topology, stacking variation and site distortion in melilite-related compounds in the system CaO-ZnO-GeO2-SiO2 low-temperature polymorph Ca2ZnGe1.25Si.75O7 American Mineralogist, 1990, 75, 847-858 |
| 9001608 | CIF | Al1.66 Ba2 F2 O10 P2 Ti0.34 | P 1 21/n 1 | 6.977; 12.564; 5.223 90; 102.15; 90 | 447.587 | Cooper, M. A.; Hawthorne, F. C. The crystal structure of curetonite, a complex heteropolyhedral sheet mineral Data has been corrected according to the ICSD American Mineralogist, 1994, 79, 545-549 |
| 9001646 | CIF | Ce O4 P | P 1 21/n 1 | 6.7902; 7.0203; 6.4674 90; 103.38; 90 | 299.928 | Ni, Y.; Hughes, J. M.; Mariano, A. N. Crystal chemistry of the monazite and xenotime structures American Mineralogist, 1995, 80, 21-26 |
| 9001647 | CIF | La O4 P | P 1 21/n 1 | 6.8313; 7.0705; 6.5034 90; 103.27; 90 | 305.732 | Ni, Y.; Hughes, J. M.; Mariano, A. N. Crystal chemistry of the monazite and xenotime structures La(PO4) American Mineralogist, 1995, 80, 21-26 |
| 9001648 | CIF | Ce O4 P | P 1 21/n 1 | 6.788; 7.0163; 6.465 90; 103.43; 90 | 299.486 | Ni, Y.; Hughes, J. M.; Mariano, A. N. Crystal chemistry of the monazite and xenotime structures Ce(PO4) American Mineralogist, 1995, 80, 21-26 |
| 9001649 | CIF | O4 P Pr | P 1 21/n 1 | 6.7596; 6.9812; 6.4344 90; 103.53; 90 | 295.213 | Ni, Y.; Hughes, J. M.; Mariano, A. N. Crystal chemistry of the monazite and xenotime structures Pr(PO4) American Mineralogist, 1995, 80, 21-26 |
| 9001650 | CIF | Nd O4 P | P 1 21/n 1 | 6.7352; 6.95; 6.4049 90; 103.68; 90 | 291.306 | Ni, Y.; Hughes, J. M.; Mariano, A. N. Crystal chemistry of the monazite and xenotime structures Nd(PO4) American Mineralogist, 1995, 80, 21-26 |
| 9001651 | CIF | O4 P Sm | P 1 21/n 1 | 6.6818; 6.8877; 6.3653 90; 103.86; 90 | 284.416 | Ni, Y.; Hughes, J. M.; Mariano, A. N. Crystal chemistry of the monazite and xenotime structures Sm(PO4) American Mineralogist, 1995, 80, 21-26 |
| 9001652 | CIF | Eu O4 P | P 1 21/n 1 | 6.6613; 6.8618; 6.3491 90; 103.96; 90 | 281.636 | Ni, Y.; Hughes, J. M.; Mariano, A. N. Crystal chemistry of the monazite and xenotime structures Eu(PO4) American Mineralogist, 1995, 80, 21-26 |
| 9001653 | CIF | Gd O4 P | P 1 21/n 1 | 6.6435; 6.8414; 6.3281 90; 103.976; 90 | 279.103 | Ni, Y.; Hughes, J. M.; Mariano, A. N. Crystal chemistry of the monazite and xenotime structures Gd(PO4) American Mineralogist, 1995, 80, 21-26 |
| 9001777 | CIF | Na2 O9 Si4 | P 1 21/n 1 | 10.875; 9.326; 19.224 90; 90.18; 90 | 1949.69 | Fleet, M. E. Sodium tetrasilicate: A complex high-pressure framework silicate (Na6Si3[Si9O27]) American Mineralogist, 1996, 81, 1105-1110 |
| 9001781 | CIF | As0.38 H4 Mn2 O9 V1.62 | P 1 21/n 1 | 7.809; 14.554; 6.705 90; 93.27; 90 | 760.797 | Brugger, J.; Berlepsch, P. Description and crystal structure of fianelite, Mn2V(V,As)O7.2H2O, a new mineral from Fianel, Val Ferrera, Graubunden, Switzerland American Mineralogist, 1996, 81, 1270-1276 |
| 9001966 | CIF | Al H O4 Si | P 1 21/n 1 | 7.14409; 4.33462; 6.95253 90; 98.369; 90 | 213.006 | Schmidt, M. W.; Finger, L. W.; Angel, R. J.; Dinnebier, R. E. Synthesis, crystal structure, and phase relations of AlSiO3OH, a high-pressure hydrous phase American Mineralogist, 1998, 83, 881-888 |
| 9002504 | CIF | Ca2.01 F2 Na1.99 O7 P2 | P 1 21/n 1 | 10.873; 10.5516; 7.4287 90; 109.74; 90 | 802.192 | Piotrowski, A.; Kahlenberg, V.; Fischer, R. X. Na2Ca2(P2O7)F2, the first diphosphate of the cuspidine family Sample: single position O1 American Mineralogist, 2000, 85, 1534-1539 |
| 9002505 | CIF | Ca1.005 F Na0.995 O3.5 P | P 1 21/n 1 | 10.873; 10.5516; 7.4287 90; 109.74; 90 | 802.192 | Piotrowski, A.; Kahlenberg, V.; Fischer, R. X. Na2Ca2(P2O7)F2, the first diphosphate of the cuspidine family Sample: split position O1 American Mineralogist, 1999, 85, 1534-1539 |
| 9002570 | CIF | Al F9 O Pb3 | P 1 21/n 1 | 25.048; 5.8459; 5.6805 90; 94.013; 90 | 829.745 | Kampf, A. R. The crystal structure of aravaipaite American Mineralogist, 2001, 86, 927-931 |
| 9002583 | CIF | K2 Mn O12 V4 | P 1 21/n 1 | 8.183; 9.247; 8.651 90; 109.74; 90 | 616.138 | Witzke, T.; Zhen, S.; Seff, K.; Doering, T.; Nasdala, L.; Kolitsch, U. Ronneburgite, K2MnV4O12, a new mineral from Ronneburg, Thuringia, Germany: Description and crystal structure American Mineralogist, 2001, 86, 1081-1086 |
| 9002897 | CIF | Ca H2 O6 Ti2 | P 1 21/n 1 | 4.9436; 12.109; 15.911 90; 98.937; 90 | 940.902 | Krivovichev, S. V.; Yakovenchuk, V. N.; Burns, P. C.; Pakhomovsky, Y. A.; Menshikov, Y. P. Cafetite, Ca[Ti2O5](H2O): Crystal structure and revision of chemical formula American Mineralogist, 2003, 88, 424-429 |
| 9003042 | CIF | C2 H12 Ca O20 U3 | P 1 21/n 1 | 6.968; 17.276; 15.377 90; 90.064; 90 | 1851.07 | Hughes, K.-A.; Burns, P. C. A new uranyl carbonate sheet in the crystal structure of fontanite, Ca[(UO2)3(CO3)2O2](H2O)6 American Mineralogist, 2003, 88, 962-966 |
| 9003568 | CIF | Ca O4 S | P 1 21/n 1 | 6.3769; 6.6439; 6.1667 90; 102.22; 90 | 255.348 | Crichton, W. A.; Parise, J. B.; Antao, S. M.; Grzechnik, A. Evidence for monazite-, barite-, and AgMnO4 (distorted barite)-type structures of CaSO4 at high pressure and temperature Sample: P = 11.8 GPa American Mineralogist, 2005, 90, 22-27 |
| 9003874 | CIF | Al H3 O3 | P 1 21/n 1 | 8.742; 5.112; 9.801 90; 94.54; 90 | 436.624 | Balan, E.; Lazzeri, M.; Morin, G.; Mauri, F. First-principles study of the OH-stretching modes of gibbsite American Mineralogist, 2006, 91, 115-119 |
| 9004039 | CIF | Ba H2 Np O7 P | P 1 21/n 1 | 6.905; 7.108; 13.321 90; 105.02; 90 | 631.468 | Forbes, T. Z.; Burns, P. C. Ba(NpO2)(PO4)(H2O), its relationship to the uranophane group, and implications for Np incorporation in uranyl minerals American Mineralogist, 2006, 91, 1089-1093 |
| 9004056 | CIF | Cu3 H2 Mo2 O10 | P 1 21/n 1 | 5.61; 14.03; 5.4 90; 98.38; 90 | 420.487 | Calvert, L. D.; Barnes, W. H. The structure of lindgrenite The Canadian Mineralogist, 1957, 6, 31-51 |
| 9004097 | CIF | Al F6 Na3 | P 1 21/n 1 | 5.4024; 5.5959; 7.7564 90; 90.278; 90 | 234.483 | Hawthorne, F. C.; Ferguson, R. B. Refinement of the crystal structure of cryolite The Canadian Mineralogist, 1975, 13, 377-382 |
| 9004171 | CIF | C Al F5 O3 Sr2 | P 1 21/n 1 | 5.45; 8.704; 13.15 90; 98.72; 90 | 616.584 | Hawthorne, F. C. The crystal structure of stenonite and the classification of the aluminofluoride minerals The Canadian Mineralogist, 1984, 22, 245-251 |
| 9004187 | CIF | Al1.38 Ca0.19 Fe0.84 Mg0.09 Mn4.28 Na2 O24 P6 Zn0.05 | P 1 21/n 1 | 12.776; 12.488; 11.035 90; 97.2; 90 | 1746.71 | Ercit, T. S.; Hawthorne, F. C.; Cerny, P. The crystal structure of bobfergusonite. The Canadian Mineralogist, 1986, 24, 605-614 |
| 9004291 | CIF | Bi2 Cu3 H6 O14 P2 | P 1 21/n 1 | 9.065; 6.34; 21.239 90; 101.57; 90 | 1195.85 | Effenberger, H.; Krause, W.; Belendorff, K.; Bernhardt, H. J.; Medenbach, O.; Hybler, J.; Petricek, V. Revision of the crystal structure of mrazekite, Bi2Cu3(OH)2O2(PO4)2.2H2O The Canadian Mineralogist, 1994, 32, 365-372 |
| 9004359 | CIF | Cu2 H2 O6 Te | P 1 21/n 1 | 9.107; 5.213; 4.605 90; 98.74; 90 | 216.083 | Grice, J. D.; Roberts, A. C. Frankhawthorneite, a unique HCP framework structure of a cupric tellurate The Canadian Mineralogist, 1995, 33, 649-653 |
| 9004403 | CIF | Cu3 H4 O8 Te | P 1 21/n 1 | 9.224; 9.18; 7.6 90; 102.38; 90 | 628.576 | Grice, J. D.; Groat, L. A.; Roberts, A. C. Jensenite, a cupric tellurate framework structure with two coordinations of copper The Canadian Mineralogist, 1996, 34, 55-59 |
| 9004404 | CIF | Cl Cu2 O3 | P 1 21/n 1 | 6.144; 6.805; 9.112 90; 99.55; 90 | 375.692 | Grice, J. D.; Szymanski, J. T.; Jambor, J. L. The crystal structure of clinoatacamite, a new polymorph of Cu2(OH)3Cl The Canadian Mineralogist, 1996, 34, 73-78 |
| 9004636 | CIF | Fe4.1 H11.32 Mg1.69 Mn0.05 O16 P | P 1 21/n 1 | 16.95; 11.65; 6.266 90; 90; 90 | 1237.33 | Sokolova, E. V.; Hawthorne, F. C.; McCammon, C. A.; Liferovich, R. P. The crystal structure of gladiusite, (Fe,Mg)4Fe2(PO4)(OH)11(H2O) The Canadian Mineralogist, 2001, 39, 1121-1130 |
| 9004734 | CIF | H12 O16 S2 V2 | P 1 21/n 1 | 7.394; 7.4111; 12.0597 90; 106.55; 90 | 633.466 | Schindler, M.; Hawthorne, F. C.; Huminicki, D. M. C.; Haynes, P.; Grice, J. D.; Evans, H. T. Bobjonesite, VO(SO4)(H2O)3, a new mineral species from Temple Mountain, Emery County, Utah, U.S.A. The Canadian Mineralogist, 2003, 41, 83-90 |
| 9004752 | CIF | Bi H O5 U | P 1 21/n 1 | 7.559; 7.811; 7.693 90; 92.88; 90 | 453.647 | Hughes, K.-A.; Burns, P. C.; Kolitsch, U. Crystal structure and crystal chemistry of uranosphaerite, Bi(UO2)O2OH Note: natural sample The Canadian Mineralogist, 2003, 41, 677-685 |
| 9004753 | CIF | Bi H O5 U | P 1 21/n 1 | 7.54; 7.801; 7.674 90; 92.948; 90 | 450.784 | Hughes, K.-A.; Burns, P. C.; Kolitsch, U. Crystal structure and crystal chemistry of uranosphaerite, Bi(UO2)O2OH Note: synthetic sample The Canadian Mineralogist, 2003, 41, 677-685 |
| 9004755 | CIF | H27 Na5 O52 S4 U8 | P 1 21/n 1 | 17.6425; 14.6272; 17.6922 90; 104.461; 90 | 4421.01 | Burns, P. C.; Deely, K. M.; Hayden, L. A. The crystal chemistry of the zippeite group Sample : Sodium-zippeite The Canadian Mineralogist, 2003, 41, 687-706 |
| 9004765 | CIF | H6 Mo2 Na2 O14 U | P 1 21/n 1 | 8.9023; 11.5149; 13.8151 90; 107.743; 90 | 1348.81 | Krivovichev, S. V.; Burns, P. C. Crystal chemistry of uranyl molybdates. VIII. Crystal structures of Na3Tl3[(UO2)(MoO4)4], Na13-xTl3+x[(UO2)(MoO4)3]4(H2O)6+x (x=0.1), Na3Tl5[(UO2)(MoO4)2]2(H2O)3 and Na2[(UO2)(MoO4)2](H2O)4 Sample 4 The Canadian Mineralogist, 2003, 41, 707-719 |
| 9004796 | CIF | Mo2 O20 Tl4 U4 | P 1 21/n 1 | 8.2527; 28.5081; 9.1555 90; 104.122; 90 | 2088.91 | Krivovichev, S. V.; Burns, P. C. Crystal chemistry of uranyl molybdates. IX. A novel uranyl molybdate sheet in the structure of Tl2[(UO2)2O(MoO5)] The Canadian Mineralogist, 2003, 41, 1225-1231 |
| 9004839 | CIF | Al0.94 Ca0.11 Fe2.16 Mg0.58 Mn3.21 Na2 O24 P6 | P 1 21/n 1 | 12.796; 12.465; 11.001 90; 97.39; 90 | 1740.11 | Tait, K. T.; Hawthorne, F. C.; Cerny, P.; Galliski, M. A. Bobfergusonite from the Nancy Pegmatite, San Luis Range, Argentina: Crystal-structure refinement and chemical composition The Canadian Mineralogist, 2004, 42, 705-716 |
| 9004860 | CIF | Cs2 H10 O17 P2 U2 | P 1 21/n 1 | 9.8716; 9.955; 17.6465 90; 90.402; 90 | 1734.11 | Locock, A. J.; Burns, P. C.; Duke, M. J. M.; Flynn, T. M. Monovalent cations in structures of the meta-autunite group Sample: CsUP The Canadian Mineralogist, 2004, 42, 973-996 |
| 9004861 | CIF | As2 Cs H11 O18 U2 | P 1 21/n 1 | 14.2614; 7.1428; 17.221 90; 91.11; 90 | 1753.91 | Locock, A. J.; Burns, P. C.; Duke, M. J. M.; Flynn, T. M. Monovalent cations in structures of the meta-autunite group Sample: CsUAs The Canadian Mineralogist, 2004, 42, 973-996 |
| 9004892 | CIF | Co H20 O22 P2 U2 | P 1 21/n 1 | 6.949; 19.9348; 6.962 90; 90.44; 90 | 964.396 | Locock, A. J.; Burns, P. C.; Flynn, M. Divalent transition metals and magnesium in structures that contain the autunite-type sheet Sample: CoUP10 The Canadian Mineralogist, 2004, 42, 1699-1718 |
| 9004893 | CIF | H20 Ni O22 P2 U2 | P 1 21/n 1 | 6.9506; 19.8215; 6.9711 90; 90.418; 90 | 960.392 | Locock, A. J.; Burns, P. C.; Flynn, M. Divalent transition metals and magnesium in structures that contain the autunite-type sheet Sample: NiUP10 The Canadian Mineralogist, 2004, 42, 1699-1718 |
| 9004894 | CIF | As2 H20 Mg O22 U2 | P 1 21/n 1 | 7.1328; 20.085; 7.1569 90; 90.585; 90 | 1025.26 | Locock, A. J.; Burns, P. C.; Flynn, M. Divalent transition metals and magnesium in structures that contain the autunite-type sheet Sample: MgUAs10 The Canadian Mineralogist, 2004, 42, 1699-1718 |
| 9004919 | CIF | B Na O4 Si | P 1 21/n 1 | 7.9845; 7.6969; 13.9432 90; 90.081; 90 | 856.891 | Graetsch, H. A.; Schreyer, W. Rietveld refinement of synthetic monoclinic NaBSiO4 The Canadian Mineralogist, 2005, 43, 759-767 |
| 9004964 | CIF | Al4 Fe0.01 H18 Ni0.55 O19 S V0.02 Zn0.39 | P 1 21/n 1 | 10.2567; 8.8815; 17.0989 90; 95.548; 90 | 1550.33 | Uvarova, Y. A.; Sokolova, E.; Hawthorne, F. C.; Karpenko, V. V.; Agakhanov, A. A.; Pautov, L. A. The crystal chemistry of the "nickelalumite"-group minerals The Canadian Mineralogist, 2005, 43, 1511-1519 |
| 9005233 | CIF | Be4 Ca2 H13 O20 P3 | P 1 21/n 1 | 6.55; 16.005; 15.969 90; 101.64; 90 | 1639.65 | Mereiter, K.; Niedermayr, G.; Walter, F. Uralolite, Ca2Be4(PO4)3(OH)3*5H2O: new data and crystal structure European Journal of Mineralogy, 1994, 6, 887-896 |
| 9005470 | CIF | H8 Mg7 O16 P2 | P 1 21/n 1 | 5.25; 11.647; 9.655 90; 95.94; 90 | 587.202 | Chopin, C.; Ferraris, G.; Prencipe, M.; Brunet, F.; Medenbach, O. Raadeite, Mg7(PO4)2(OH)8: a new dense-packed phosphate from Modum (Norway) European Journal of Mineralogy, 2001, 13, 319-327 |
| 9005478 | CIF | Al1.817 Ca Fe0.183 O4 | P 1 21/n 1 | 8.758; 8.112; 15.311 90; 90.21; 90 | 1087.76 | Kahlenberg, V. On the Al/Fe substitution in iron doped monocalcium aluminate - the crystal structure of CaAl1.8Fe0.2O4 European Journal of Mineralogy, 2001, 13, 403-410 |
| 9005636 | CIF | As0.71 Ca0.01 Ce0.77 La0.1 Nd0.1 O4 P0.29 Pr0.02 | P 1 21/n 1 | 6.929; 7.129; 6.697 90; 104.46; 90 | 320.331 | Kolitsch, U.; Holtstam, D.; Gatedal, K. Crystal chemistry of REEXO4 compounds (X = P, As, V). I. Paragenesis and crystal structure of phosphatian gasparite-(Ce) from the Kesebol Mn-Fe-Cu deposit, Vastra Gotaland, Sweden European Journal of Mineralogy, 2004, 16, 111-116 |
| 9005740 | CIF | Al1.846 Fe3.996 Mn0.366 Na0.501 O24 P6 | P 1 21/n 1 | 11.838; 12.347; 6.2973 90; 114.353; 90 | 838.539 | Hatert, F.; Lefevre, P.; Fransolet, A. M.; Spirlet, M. R.; Rebbouh, L.; Fontan, F.; Keller, P. Ferrorosemaryite, NaFe2+Fe3+Al(PO4)3, a new phosphate mineral from the Rubindi pegmatite, Rwanda European Journal of Mineralogy, 2005, 17, 749-759 |
| 9006157 | CIF | Al F6 Na3 | P 1 21/n 1 | 5.4139; 5.6012; 7.7769 90; 90.183; 90 | 235.828 | Yang, H.; Ghose, S.; Hatch, D. M. Ferroelastic phase transition in cryolite, Na3AlF6, a mixed fluoride perovskite: high temperature single crystal X-ray diffraction study and symmetry analysis of the transition mechanism Sample: T = 295 K Physics and Chemistry of Minerals, 1993, 19, 528-544 |
| 9006158 | CIF | Al F6 Na3 | P 1 21/n 1 | 5.4306; 5.6069; 7.7944 90; 90.155; 90 | 237.33 | Yang, H.; Ghose, S.; Hatch, D. M. Ferroelastic phase transition in cryolite, Na3AlF6, a mixed fluoride perovskite: high temperature single crystal X-ray diffraction study and symmetry analysis of the transition mechanism Sample: T = 373 K Physics and Chemistry of Minerals, 1993, 19, 528-544 |
| 9006159 | CIF | Al F6 Na3 | P 1 21/n 1 | 5.4544; 5.6155; 7.822 90; 90.118; 90 | 239.581 | Yang, H.; Ghose, S.; Hatch, D. M. Ferroelastic phase transition in cryolite, Na3AlF6, a mixed fluoride perovskite: high temperature single crystal X-ray diffraction study and symmetry analysis of the transition mechanism Sample: T = 473 K Physics and Chemistry of Minerals, 1993, 19, 528-544 |
| 9006160 | CIF | Al F6 Na3 | P 1 21/n 1 | 5.4766; 5.6227; 7.8461 90; 90.089; 90 | 241.607 | Yang, H.; Ghose, S.; Hatch, D. M. Ferroelastic phase transition in cryolite, Na3AlF6, a mixed fluoride perovskite: high temperature single crystal X-ray diffraction study and symmetry analysis of the transition mechanism Sample: T = 573 K Physics and Chemistry of Minerals, 1993, 19, 528-544 |
| 9006161 | CIF | Al F6 Na3 | P 1 21/n 1 | 5.5022; 5.6284; 7.8725 90; 90.055; 90 | 243.8 | Yang, H.; Ghose, S.; Hatch, D. M. Ferroelastic phase transition in cryolite, Na3AlF6, a mixed fluoride perovskite: high temperature single crystal X-ray diffraction study and symmetry analysis of the transition mechanism Sample: T = 673 K Physics and Chemistry of Minerals, 1993, 19, 528-544 |
| 9006162 | CIF | Al F6 Na3 | P 1 21/n 1 | 5.5395; 5.6378; 7.9085 90; 90.011; 90 | 246.987 | Yang, H.; Ghose, S.; Hatch, D. M. Ferroelastic phase transition in cryolite, Na3AlF6, a mixed fluoride perovskite: high temperature single crystal X-ray diffraction study and symmetry analysis of the transition mechanism Sample: T = 800 K Physics and Chemistry of Minerals, 1993, 19, 528-544 |
| 9006163 | CIF | Al F6 Na3 | P 1 21/n 1 | 5.5443; 5.6391; 7.9127 90; 90.098; 90 | 247.389 | Yang, H.; Ghose, S.; Hatch, D. M. Ferroelastic phase transition in cryolite, Na3AlF6, a mixed fluoride perovskite: high temperature single crystal X-ray diffraction study and symmetry analysis of the transition mechanism Sample: T = 820 K Note: beta angle has been altered in order to reproduce bond lengths Physics and Chemistry of Minerals, 1993, 19, 528-544 |
| 9006164 | CIF | Al F6 Na3 | P 1 21/n 1 | 5.5558; 5.6437; 7.9263 90; 90.001; 90 | 248.531 | Yang, H.; Ghose, S.; Hatch, D. M. Ferroelastic phase transition in cryolite, Na3AlF6, a mixed fluoride perovskite: high temperature single crystal X-ray diffraction study and symmetry analysis of the transition mechanism Sample: T = 840 K Physics and Chemistry of Minerals, 1993, 19, 528-544 |
| 9006165 | CIF | Al F6 Na3 | P 1 21/n 1 | 5.5659; 5.642; 7.9322 90; 89.989; 90 | 249.093 | Yang, H.; Ghose, S.; Hatch, D. M. Ferroelastic phase transition in cryolite, Na3AlF6, a mixed fluoride perovskite: high temperature single crystal X-ray diffraction study and symmetry analysis of the transition mechanism Sample: T = 860 K Physics and Chemistry of Minerals, 1993, 19, 528-544 |
| 9006166 | CIF | Al F6 Na3 | P 1 21/n 1 | 5.5732; 5.6414; 7.9365 90; 89.99; 90 | 249.529 | Yang, H.; Ghose, S.; Hatch, D. M. Ferroelastic phase transition in cryolite, Na3AlF6, a mixed fluoride perovskite: high temperature single crystal X-ray diffraction study and symmetry analysis of the transition mechanism Sample: T = 880 K Physics and Chemistry of Minerals, 1993, 19, 528-544 |
| 9006830 | CIF | Fe3 H2 O10 P2 | P 1 21/n 1 | 7.3294; 7.4921; 7.4148 90; 118.43; 90 | 358.061 | Redhammer, G. J.; Tippelt, G.; Roth, G.; Lottermoser, W.; Amthauer, G. Structure and Mossbauer spectroscopy of barbosalite Fe2+Fe3+2(PO4)2(OH)2 between 80 K and 300 K Sample: T = 298 K Physics and Chemistry of Minerals, 2000, 27, 419-429 |
| 9006831 | CIF | Fe3 H2 O10 P2 | P 1 21/n 1 | 7.3065; 7.5026; 7.4105 90; 118.49; 90 | 357.033 | Redhammer, G. J.; Tippelt, G.; Roth, G.; Lottermoser, W.; Amthauer, G. Structure and Mossbauer spectroscopy of barbosalite Fe2+Fe3+2(PO4)2(OH)2 between 80 K and 300 K Sample: T = 110 K Physics and Chemistry of Minerals, 2000, 27, 419-429 |
| 9007473 | CIF | Fe2 H16 O16 S2 | P 1 21/n 1 | 5.979; 13.648; 7.977 90; 90.43; 90 | 650.916 | Baur, W. H. Zur kristallchemie der salzhydrate. Die kristallstrukturen von MgSO4*4H2O (leonhardtit) und FeSO4*4H2O (rozenit) Locality: synthetic Acta Crystallographica, 1962, 15, 815-826 |
| 9007480 | CIF | H8 Mg O8 S | P 1 21/n 1 | 5.922; 13.604; 7.905 90; 90.85; 90 | 636.78 | Baur, W. H. On the crystal chemistry of salt hydrates. II. A neutron diffraction study of MgSO4*4H2O Acta Crystallographica, 1964, 17, 863-869 |
| 9007486 | CIF | Cr O4 Pb | P 1 21/n 1 | 7.12; 7.43; 6.79 90; 102.42; 90 | 350.796 | Quareni, S.; De Pieri, R. A three-dimensional refinement of the structure of crocoite, PbCrO4 Acta Crystallographica, 1965, 19, 287-289 |
| 9007502 | CIF | Fe1.08 H15 Mg0.2 Mn0.25 O16 S2 Zn0.47 | P 1 21/n 1 | 10.526; 17.872; 7.136 90; 100.13; 90 | 1321.5 | Susse, P. Die kristallstruktur des botryogens Acta Crystallographica, Section B, 1968, 24, 760-767 |
| 9007515 | CIF | As H15 Na2 O11 | P 1 21/n 1 | 9.401; 11.025; 10.674 90; 95.5; 90 | 1101.22 | Baur, W. H.; Khan, A. A. On the crystal chemistry of salt hydrates. VI. The crystal structures of disodium hydrogen orthoarsenate heptahydrate and of disodium hydrogen orthophosphate heptahydrate Acta Crystallographica, Section B, 1970, 26, 1584-1596 |
| 9007516 | CIF | H15 Na2 O11 P | P 1 21/n 1 | 9.258; 11.007; 10.437 90; 95.61; 90 | 1058.47 | Baur, W. H.; Khan, A. A. On the crystal chemistry of salt hydrates. VI. The crystal structures of disodium hydrogen orthoarsenate heptahydrate and of disodium hydrogen orthophosphate heptahydrate Acta Crystallographica, Section B, 1970, 26, 1584-1596 |
| 9007549 | CIF | C H6 Mg O6 | P 1 21/n 1 | 7.7053; 5.3673; 12.1212 90; 90.451; 90 | 501.277 | Stephan, G. W.; MacGillavry, C. H. The crystal structure of nesquehonite, MgCO3*3H2O Acta Crystallographica, Section B, 1972, 28, 1031-1033 |
| 9007577 | CIF | Al H4 O6 P | P 1 21/n 1 | 5.178; 9.514; 8.454 90; 90.35; 90 | 416.466 | Kniep, R.; Mootz, D. Metavariscite - A redetermination of its crystal structure Acta Crystallographica, Section B, 1973, 29, 2292-2294 |
| 9007592 | CIF | Al3 H4 Na O12 P2 | P 1 21/n 1 | 11.233; 10.142; 7.097 90; 97.37; 90 | 801.847 | Gatehouse, B. M.; Miskin, B. K. The crystal structure of brazilianite, NaAl3(PO4)2(OH)4 Acta Crystallographica, Section B, 1974, 30, 1311-1317 |
| 9007594 | CIF | As5 Ca6.25 H20 O30 | P 1 21/n 1 | 17.63; 6.734; 23.47 90; 90.6; 90 | 2786.22 | Catti, M.; Ferraris, G. Crystal structure of Ca5(HAsO4)2(AsO4)2*9H2O (guerinite) Acta Crystallographica, Section B, 1974, 30, 1789-1794 |
| 9007625 | CIF | O4 Si Th | P 1 21/n 1 | 6.784; 6.974; 6.5 90; 104.92; 90 | 297.158 | Taylor, M.; Ewing, R. C. The crystal structure of the ThSiO4 polymorphs: huttonite and thorite Acta Crystallographica, Section B, 1978, 34, 1074-1079 |
| 9007629 | CIF | As H Mn4 O13 Si3 | P 1 21/n 1 | 6.66; 19.92; 7.67 90; 95.7; 90 | 1012.53 | Gramaccioli, C. M.; Pilati, T.; Liborio, G. Structure of a manganese(II) arsenatotrisilicate, Mn4[AsSi3O12(OH)]: The presence of a new tetrapolyphosphate-like anion Note: Displacement parameters taken from ICSD Acta Crystallographica, Section B, 1979, 35, 2287-2291 |
| 9007742 | CIF | C H F3 O3 S | P 1 21/n 1 | 4.947; 11.26; 8.457 90; 99.21; 90 | 465.009 | Bartmann, K.; Mootz, D. Structures of two strong Bronsted acids: (I) fluorosulfuric acid and (II) trifluoromethanesulfonic acid Sample: T = 173 K Acta Crystallographica, Section C, 1990, 46, 319-320 |
| 9007840 | CIF | La Na O6 Se2 | P 1 21/n 1 | 6.696; 6.761; 13.199 90; 101.51; 90 | 585.524 | Morris, R. E.; Hriljac, J. A.; Cheetham, A. K. Synthesis and crystal structures of two novel selenites, NaY(SeO3)2 and NaLa(SeO3)2 Acta Crystallographica, Section C, 1990, 46, 2013-2017 |
| 9007860 | CIF | C24 K O2 V | P 1 21/n 1 | 10.213; 18.518; 13.402 90; 89.58; 90 | 2534.58 | Braga, D.; Sabatino, P. Bis(arene)vanadium complexes. A structural study Sample: 2 Acta Crystallographica, Section C, 1990, 46, 2308-2312 |
| 9007894 | CIF | H4 Mg O5 Se | P 1 21/n 1 | 6.4818; 8.7975; 7.6367 90; 98.753; 90 | 430.401 | Johnston, M. G.; Harrison, W. T. A. Magnesium selenite dihydrate, MgSeO3*2H2O Acta Crystallographica, Section E, 2001, 57, i24-i25 |
| 9007916 | CIF | Mg O7 P2 Sr | P 1 21/n 1 | 5.3046; 8.3053; 12.7 90; 90.502; 90 | 559.493 | Tahiri, A. A.; Bali, B. E.; Lachkar, M.; Ouarsal, R.; Zavalij, P. Y. SrMgP2O7 Acta Crystallographica, Section E, 2002, 58, i9-i11 |
| 9007925 | CIF | Dy4 S12 Si3 | P 1 21/n 1 | 9.813; 10.9387; 16.36 90; 102.86; 90 | 1712.06 | Hatscher, S. T.; Urland, W. Dysprosium thiosilicate, Dy4(SiS4)3 Acta Crystallographica, Section E, 2002, 58, i74-i75 |
| 9008005 | CIF | Fe2 H5 Na O11 P2 | P 1 21/n 1 | 9.766; 9.692; 9.811 90; 102.53; 90 | 906.514 | Gao, S.; Ng, S. W. Sodium diiron(III) diphosphate hydroxide dihydrate Acta Crystallographica, Section E, 2005, 61, i268-i269 |
| 9008142 | CIF | Cr Cu H O9 P Pb2 | P 1 21/n 1 | 13.754; 5.806; 9.563 90; 94.57; 90 | 761.232 | Fanfani, L.; Zanazzi, P. F. The crystal structure of vauquelinite and the relationships to fornacite Zeitschrift fur Kristallographie, 1968, 126, 433-443 |
| 9008210 | CIF | As S | P 1 21/n 1 | 9.325; 13.571; 6.587 90; 106.38; 90 | 799.749 | Mullen, D. J. E.; Nowacki, W. Refinement of the crystal structures of realgar, AsS and orpiment, As2S3 Zeitschrift fur Kristallographie, 1972, 136, 48-65 |
| 9008211 | CIF | As2 S3 | P 1 21/n 1 | 11.475; 9.577; 4.256 90; 90.68; 90 | 467.685 | Mullen, D. J. E.; Nowacki, W. Refinement of the crystal structures of realgar, AsS and orpiment, As2S3 Zeitschrift fur Kristallographie, 1972, 136, 48-65 |
| 9008240 | CIF | Ag4 Mn S6 Sb2 | P 1 21/n 1 | 10.362; 8.101; 6.647 90; 92.63; 90 | 557.378 | Edenharter, A.; Nowacki, W. Verfeinerung der kristallstruktur von samsonit (SbS3)2Ag2Ag2Mn Zeitschrift fur Kristallographie, 1974, 140, 87-99 |
| 9008249 | CIF | Fe2 O12 S3 | P 1 21/n 1 | 8.2955; 8.5332; 11.6304 90; 90.25; 90 | 823.275 | Christidis, P. C.; Rentzeperis, P. J. The crystal structure of the monoclinic Fe2(SO4)3 Zeitschrift fur Kristallographie, 1975, 141, 233-245 |
| 9008252 | CIF | Hg O4 P | P 1 21/n 1 | 6.0754; 14.5034; 4.728 90; 92.172; 90 | 416.303 | Nilsson, B. A. The crystal structure of mercury(I) dihydrogenphosphate, Hg2(H2PO4)2 Zeitschrift fur Kristallographie, 1975, 141, 321-329 |
| 9008257 | CIF | As3.75 S6.33 Tl1.4 | P 1 21/n 1 | 8.755; 24.425; 5.739 90; 108.28; 90 | 1165.3 | Divjakovic, V.; Nowacki, W. Die kristallstruktur von imhofit, Tl5.6As15S25.3 Zeitschrift fur Kristallographie, 1976, 144, 323-333 |
| 9008259 | CIF | As Hg S3 Tl | P 1 21/n 1 | 6.113; 16.188; 6.111 90; 96.71; 90 | 600.585 | Brown, K. L.; Dickson, F. W. The crystal structure of synthetic christite, HgTlAsS3 Zeitschrift fur Kristallographie, 1976, 144, 367-376 |
| 9008261 | CIF | Be3 Ca Mn2 O12 Si3 | P 1 21/n 1 | 8.098; 7.613; 14.065 90; 90; 90 | 867.108 | Klaska, K. H.; Jarchow, O. Die Bestimmung der kristallstruktur von trimerit CaMn2(BeSiO4)3 und das trimeritgesetz der verzwillingung Zeitschrift fur Kristallographie, 1977, 145, 46-65 |
| 9008272 | CIF | C2 H2 Cu Na2 O9 | P 1 21/n 1 | 9.696; 6.101; 13.779 90; 91.83; 90 | 814.685 | Mosset, A.; Bonnet, J. J.; Galy, J. Structure cristalline de la chalconatronite synthetique: Na2Cu(CO3)2*3H2O Zeitschrift fur Kristallographie, 1978, 148, 165-177 |
| 9008288 | CIF | Cu31 S16 | P 1 21/n 1 | 26.897; 15.745; 13.565 90; 90.13; 90 | 5744.67 | Evans, H. T. The crystal structures of low chalocite and djurleite Zeitschrift fur Kristallographie, 1979, 150, 299-320 |
| 9008305 | CIF | As3 Hg S6 Tl | P 1 21/n 1 | 5.948; 11.404; 15.979 90; 90.15; 90 | 1083.87 | Engel, P.; Nowacki, W.; Balic-Zunic T; Scavnicar, S. The crystal structure of simonite, TlHgAs3S6 Zeitschrift fur Kristallographie, 1982, 161, 159-166 |
| 9008367 | CIF | Al2 H22 O20 S2 | P 1 21/n 1 | 8.3965; 12.479; 8.1549 90; 101.917; 90 | 836.054 | Sabelli, C. Refinement of the crystal structure of jurbanite, Al(SO4)(OH)*5H2O Locality: Cetine mine, Tuscany, Italy Zeitschrift fur Kristallographie, 1985, 173, 33-39 |
| 9008581 | CIF | Se8 | P 1 21/n 1 | 9.05; 9.07; 11.61 90; 90.767; 90 | 952.904 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Sample is the alpha form of the monoclinic phase Crystal Structures, 1963, 1, 7-83 |
| 9008994 | CIF | N S | P 1 21/n 1 | 8.75; 7.16; 8.65 90; 87.5; 90 | 541.407 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Crystal Structures, 1963, 1, 85-237 |
| 9009094 | CIF | Cu F2 | P 1 21/n 1 | 4.59; 4.54; 3.32 90; 96.67; 90 | 68.716 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Crystal Structures, 1963, 1, 239-444 |
| 9009095 | CIF | Cr F2 | P 1 21/n 1 | 4.732; 4.718; 3.505 90; 96.5; 90 | 77.748 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Crystal Structures, 1963, 1, 239-444 |
| 9009320 | CIF | Ca0.69 F2 Mn3 Na2.31 O16 Si4 Ti1.4 Zr0.6 | P 1 21/n 1 | 10.668; 9.787; 13.931 90; 107.82; 90 | 1384.72 | Annehed, H.; Falth, L.; Raade, G. The crystal structure of janhaugite, a sorosilicate of the cuspidine family Neues Jahrbuch fur Mineralogie, Monatshefte, 1985, 1985, 7-18 |
| 9009321 | CIF | Cu3 H2 Mo2 O10 | P 1 21/n 1 | 5.394; 14.023; 5.608 90; 98.5; 90 | 419.53 | Hawthorne, F. C.; Eby, R. K. Refinement of the crystal structure of lindgrenite Neues Jahrbuch fur Mineralogie, Monatshefte, 1985, 1985, 234-240 |
| 9009363 | CIF | Co H4 O5 Se | P 1 21/n 1 | 6.496; 8.809; 7.619 90; 98.87; 90 | 430.77 | Wildner, M. Crystal structure refinements of synthetic cobaltomenite (CoSeO3*2H2O) and ahlfeldite (NiSeO3*2H2O) Neues Jahrbuch fur Mineralogie, Monatshefte, 1990, 1990, 353-362 |
| 9009364 | CIF | H4 Ni O5 Se | P 1 21/n 1 | 6.441; 8.746; 7.522 90; 99; 90 | 418.52 | Wildner, M. Crystal structure refinements of synthetic cobaltomenite (CoSeO3*2H2O) and ahlfeldite (NiSeO3*2H2O) Neues Jahrbuch fur Mineralogie, Monatshefte, 1990, 1990, 353-362 |
| 9009365 | CIF | Al4 H16 O20 V2 Zn | P 1 21/n 1 | 17.808; 5.132; 8.881 90; 92.11; 90 | 811.09 | Pertlik, F.; Dunn, P. J. Crystal structure of alvanite, (Zn,Ni)Al4(VO3)2(OH)12*2H2O, the first example of an unbranched zweier-single chain vanadate in nature Neues Jahrbuch fur Mineralogie, Monatshefte, 1990, 1990, 385-392 |
| 9009570 | CIF | Be Na O4 P | P 1 21/n 1 | 8.178; 7.818; 14.114 90; 90; 90 | 902.387 | Giuseppetti, G.; Tadini, C. Refinement of the crystal structure of beryllonite Tschermaks Mineralogische und Petrographische Mitteilungen, 1973, 20, 1-12 |
| 9009691 | CIF | As2 O3 | P 1 21/n 1 | 7.99; 4.645; 9.115 90; 78.3; 90 | 331.261 | Pertlik, F. Die kristallstruktur der monoklinen form von As2O3 (Claudetit II) Monatshefte fur Chemie, 1975, 106, 755-762 |
| 9009693 | CIF | As2 O3 | P 1 21/n 1 | 5.25; 12.99; 4.53 90; 93.88; 90 | 308.227 | Pertlik, F. Verfeinerung der kristallstruktur des minerals claudetit Monatshefte fur Chemie, 1978, 109, 277-282 |
| 9009711 | CIF | C2 H16 B2 Ca2 Mg O18 | P 1 21/n 1 | 11.011; 6.674; 10.692 90; 116.64; 90 | 702.316 | Zhesheng, M.; Nicheng, S.; Jinchuan, S.; Zhizhong, P. The refinement of the crystal structure of carboborite MgCa2[CO3]2[B(OH)4]2*4H2O Bulletin de Mineralogie, 1981, 104, 578-581 |
| 9009797 | CIF | As2 O3 | P 1 21/n 1 | 5.25; 12.9; 4.53 90; 93.88; 90 | 306.091 | Becker, K. A.; Plieth, K.; Stranski, I. N. Strukturuntersuchung der monoklinen arsenikmodifikation claudetit Zeitschrift fur Anorganische und Allgemeine Chemie, 1951, 266, 293-301 |
| 9009807 | CIF | As O3 Sb | P 1 21/n 1 | 4.58; 13.16; 5.44 90; 95; 90 | 326.636 | Bodenstein, D.; Brehm, A.; Jones, P. G.; Schwarzmann, E.; Sheldrick, G. M. Darstellung und kristallstruktur von monoklinem arsen(III)antimon(III)oxid, AsSbO3 Zeitschrift fur Naturforschung B, 1983, 38, 901-904 |
| 9009808 | CIF | Al2 H5 K O11 P2 | P 1 21/n 1 | 9.499; 9.503; 9.535 90; 103.26; 90 | 837.768 | Dick, S. Uber die struktur von synthetischem tinsleyit K[Al2(PO4)2(OH)(H2O)]*(H2O) Zeitschrift fur Naturforschung B, 1999, 54, 1385-1390 |
| 9009934 | CIF | Fe1.08 H14 Mg0.2 Mn0.25 O16 S2 Zn0.47 | P 1 21/n 1 | 10.51; 17.85; 7.14 90; 100; 90 | 1319.14 | Suesse P Die kristallstruktur des botryogens Locality: Quetena, Chile Naturwissenschaften, 1967, 54, 139-139 |
| 9010008 | CIF | Fe H4 O6 P | P 1 21/n 1 | 5.335; 9.808; 8.72 90; 90.54; 90 | 456.26 | Taxer, K.; Bartl, H. On the dimorphy between the variscite and clinovariscite group: refined finestructural relationship of strengite and clinostrengite, Fe(PO4)*2H2O Crystal Research and Technology, 2004, 39, 1080-1088 |
| 9010020 | CIF | Al2.502 H26 K0.5 Mg0.25 Na1.5 O42.5 Si15.498 | P 1 21/n 1 | 18.886; 14.182; 7.47 90; 90; 90 | 2000.77 | Gramlich-Meier R; Gramlich, V.; Meier, W. M. The crystal structure of the monoclinic variety of ferrierite American Mineralogist, 1985, 70, 619-623 |
| 9010054 | CIF | As S | P 1 21/n 1 | 9.327; 13.563; 6.59 90; 106.46; 90 | 799.484 | Kyono, A.; Kimata, M.; Hatta, T. Light-induced degradation dynamics in realgar: in situ structural investigation using single crystal X-ray diffraction and X-ray photoelectron spectroscopy Sample: Getchell mine, Nevada; t = 0 hours Note: space group corrected American Mineralogist, 2005, 90, 1563-1570 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!

