Crystallography Open Database
Search results
Result: there are 4631 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 space group like 'C 1 c 1'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 8100427 | CIF | C58 H68 O8 S2 | C 1 c 1 | 23.888; 11.225; 21.431 90; 112.41; 90 | 5312.6 | Paulus, E. F.; Joswig, W.; Boehmer, V.; Saadioui, M.; Krilow, M.; Peikert-Regelien, M.; Urschel, B. Crystal structure of 5,11,17,23-tetra-t-butyl-25,27-dihydroxy- 26, 28-di-tosyloxy-calix[4]arene, C~58~H~68~O~8~S~2~ Zeitschrift für Kristallographie - New Crystal Structures, 2003, 218, 429-431 |
| 8100449 | CIF | C36 H48 Cu2 F4 N10 O13 | C 1 c 1 | 14.87; 20.778; 14.66 90; 101.308; 90 | 4441 | Zhu, Hai-Liang; Shao, Si-Chang; Ma, Ji-Long; Qiu, Xiao-Yang; Yang, Song; Sun, Lin Crystal structure of bis[dinitrato-2,5,8-triaza-1,9-di (2-fluorobenzylnonanecopper(II)] monohydrate, Cu(C~18~H~22~F~2~N~5~O~6~)~2~ · H~2~O Zeitschrift für Kristallographie - New Crystal Structures, 2003, 218, 506-508 |
| 8100541 | CIF | C24 H22 N2 O3 | C 1 c 1 | 15.462; 11.446; 23.005 90; 94.199; 90 | 4060.5 | Patel, Urmila H.; Dave, Chaitanya G.; Jotani, Mukesh M.; Shah, Hetal C. Crystal structure of 2-(O,O-isopropyledene-2,3-dihydroxypropoxy)-3- cyano-4,6-diphenylpyridine, C~24~H~22~N~2~O~3~ Zeitschrift für Kristallographie - New Crystal Structures, 2002, 217, 32-34 |
| 8100573 | CIF | C21 H29 N5 O5 S3 | C 1 c 1 | 11.682; 21.926; 10.668 90; 107.6; 90 | 2604.6 | Romba, J.; Steinhauser, S.; Hegetschweiler, K. Crystal structure of 6-azido-1,4-bis(tosyl)-1,4-diazepane—DMSO (1:1), C~19~H~23~N~5~O~4~S~2~ · C~2~H~6~OS Zeitschrift für Kristallographie - New Crystal Structures, 2002, 217, 135-136 |
| 8100860 | CIF | C18 H45 B3 N6 | C 1 c 1 | 19.52; 11.3663; 12.171 90; 113.952; 90 | 2467.8 | Toury, Berangere; Miele, Philippe; Cornu, David; Lecocq, Sylvain; Bonnetot, Bernard Crystal structure of 2,4,6-tri(diisopropylamino)borazine, C~18~H~45~B~3~N~6~ Zeitschrift für Kristallographie - New Crystal Structures, 2001, 216, 115-116 |
| 8100910 | CIF | Cd4 Ge Se6 | C 1 c 1 | 12.863; 7.422; 14.782 90; 125.02; 90 | 1155.7 | Hesse, K.-F.; Czank, M.; Nemcsics, A. Crystal structure of cadmium germanium selenide, Cd~4~GeSe~6~ Zeitschrift für Kristallographie - New Crystal Structures, 2001, 216, 39-40 |
| 8100919 | CIF | C28 H64 Cd4 N24 O24 S12 | C 1 c 1 | 17.732; 17.9054; 20.6992 90; 94.111; 90 | 6555 | Zhou, Mei; Yu, Wen Tao; Xu, Dong; Lu, Meng Kai; Yuan, Duo Rong; Wang, Xin Qiang; Gou, Shi Yi; Meng, Fan Qing Crystal structure of (DL)-trithioureatartrato-O^1^,O^2^,O^3^-cadmium, C~28~H~64~Cd~4~N~24~O~24~S~12~ Zeitschrift für Kristallographie - New Crystal Structures, 2001, 216, 201-204 |
| 8101056 | CIF | Ga2 S3 | C 1 c 1 | 11.107; 6.395; 7.021 90; 121.17; 90 | 426.7 | Jones, Camille Y.; Bryan, Jeffrey C.; Kirschbaum, Kristin; Edwards, Jimmie G. Refinement of the crystal structure of digallium trisulfide, Ga~2~S~3~ Zeitschrift für Kristallographie - New Crystal Structures, 2001, 216, 327-328 |
| 8101116 | CIF | C25 H30 O3 Si | C 1 c 1 | 10.385; 16.748; 13.381 90; 104.1; 90 | 2257.2 | Tinant, Bernard; Depré, Dominique; Ghosez, Léon Crystal structure of (1R,5S,6S,7R)-7-(tert-butyldiphenylsilyloxy)- 6-vinyl-2-oxabicyclo[3.3.0]octan-3-one, C~25~H~30~O~3~Si Zeitschrift für Kristallographie - New Crystal Structures, 2001, 216, 643-644 |
| 8101119 | CIF | C15 H15 N | C 1 c 1 | 10.7295; 15.1279; 7.7526 90; 108.839; 90 | 1191 | Sourdon, V.; Boyer, G.; Galy, J.-P. Crystal structure of 4,9-dimethyl-9,10-dihydroacridine, C~15~H~15~N Zeitschrift für Kristallographie - New Crystal Structures, 2001, 216, 645-646 |
| 8101175 | CIF | C18 H19 O P | C 1 c 1 | 16.144; 6.239; 16.387 90; 106.56; 90 | 1582.1 | Böduel, Rainer René; Hölemann, Alexandra; Schürmann, Markus; Preut, Hans; Mitchell, Terence Crystal structure of 1-hexynyl(diphenyl)phosphine oxide, C~18~H~19~OP Zeitschrift für Kristallographie - New Crystal Structures, 2000, 215, 117-118 |
| 8101374 | CIF | C13 H16 O | C 1 c 1 | 7.104; 28.784; 5.444 90; 106.21; 90 | 1068.9 | Kakou-Yao, R.; Aycard, J. P. Crystal structure of (6-phenylcyclohex-3-enyl)methanol, C~13~H~16~O Zeitschrift für Kristallographie - New Crystal Structures, 2000, 215, 569-570 |
| 8101522 | CIF | C19 H18 O3 | C 1 c 1 | 6.1829; 34.03; 7.4127 90; 90.045; 90 | 1559.7 | Shan, Yongkui; Zhou, Hongping; Huang, Songping D. Crystal structure of 1,5-bis(4-methoxyphenyl)-1,4-pentadien-3-one, C~19~H~18~O~3~ Zeitschrift für Kristallographie - New Crystal Structures, 1999, 214, 381-382 |
| 8101645 | CIF | C15 H10 O3 | C 1 c 1 | 5.234; 21.121; 10.243 90; 93.52; 90 | 1130.2 | Shoja, Massud; Yen, Mei-Wen; Peterson, Luke Crystal structure of 6-hydroxyflavone, C~15~H~10~O~3~ Zeitschrift für Kristallographie - New Crystal Structures, 1998, 213, 729-730 |
| 8101790 | CIF | C7 H7 Cl N2 | C 1 c 1 | 5.658; 15.406; 8.234 90; 93.18; 90 | 716.6 | Oueslati, A.; Kefi, R.; Akriche, S.; Ben Nasr, C. Crystal structure of o-cyanoaniline hydrochloride, (NCC~6~H~4~NH~3~)Cl Zeitschrift für Kristallographie - New Crystal Structures, 2005, 220, 365-366 |
| 8101855 | CIF | C19 H22 N2 | C 1 c 1 | 8.6358; 15.162; 12.807 90; 106.599; 90 | 1607 | Amani, A.; Rezanejade Bardajee, G.; Jafarpour, F.; Razaghi, M. O.; Yousefi Behzadi, M.; Haeri, A. Crystal structure of 2,2-diphenyl-4-dimethyl-aminopentanenitrile, C~19~H~22~N~2~ Zeitschrift für Kristallographie - New Crystal Structures, 2005, 220, 549-550 |
| 8101940 | CIF | C9 H14 Br N O | C 1 c 1 | 6.0786; 19.095; 8.1687 90; 95.231; 90 | 944.2 | Frey, W.; Gulla, M.; Jäger, V. Crystal structure of rel-(2R,3aS)-2-bromomethyl-3,3a,4,5,6,7-hexahydro- 2H-indole 1-oxide, C~9~H~14~BrNO Zeitschrift für Kristallographie - New Crystal Structures, 2006, 221, 89-90 |
| 8102443 | CIF | C20 H12 Cl2 F3 N5 O2 S | C 1 c 1 | 12.501; 24.987; 7.667 90; 108.185; 90 | 2275.3 | Xiao-Hong Zhang; Ping Zhong Crystal structure of N-[1-(2,6-dichloro-4-trifluoromethyl)phenyl-3-cyano-1H-pyrazol-5-yl]-N'-4-methoxybenzoyl thioureas, C20H12Cl2F3N5O2S Zeitschrift für Kristallographie - New Crystal Structures, 2009, 224, 395 |
| 8102508 | CIF | C18 H19 F6 N2 O2 P | C 1 c 1 | 8.2953; 20.7322; 11.5293 90; 92.737; 90 | 1980.55 | Alexander Schwärzler; Gerhard Laus; Klaus Wurst; Günther Bonn; Herwig Schottenberger Crystal structure of 1,3-dibenzyloxy-2-methylimidazolium hexafluorophosphate, [C18H19N2O2][PF6] Zeitschrift für Kristallographie - New Crystal Structures, 2009, 224, 595 |
| 8102642 | CIF | C22 H18 N4 O4 Zn | C 1 c 1 | 13.471; 17.738; 8.5993 90; 96.635; 90 | 2041 | Man-Sheng Chen; Yi-Fang Deng; Chun-Hua Zhang; Dai-Zhi Kuang Crystal structure of (bis(4-((1H-imidazol-1-yl)methyl)benzoato)zinc(II), Zn(C11H14N2O2)2 Zeitschrift für Kristallographie - New Crystal Structures, 2010, 225, 151 |
| 8102780 | CIF | C9 H7 Mg N2 O6 | C 1 c 1 | 7.4793; 18.958; 7.3132 90; 99.38; 90 | 1023.1 | Lei Teng Crystal structure of catena-diaqua[m-(1H-benzimidazole-5,6-dicarboxylato)-k4N:O:O']magnesium(II), Mg(H2O)2(C9H3N2O4) Zeitschrift für Kristallographie - New Crystal Structures, 2010, 225, 427 |
| 8102793 | CIF | C26 H58 Ce N3 O21 P4 | C 1 c 1 | 18.347; 11.91; 23.415 90; 104.327; 90 | 4957 | Rong Wang; Kai-Jun Mu; Shuang-Feng Deng; Qiong-Hua Jin; Cun-Lin Zhang Crystal structure of bis(O,O'-tetraisopropylmethylenediphosphonate)cerium(III) trinitrate, Ce(NO3)3[CH2P2O2(C3H7O)4]2 Zeitschrift für Kristallographie - New Crystal Structures, 2010, 225, 613 |
| 8103128 | CIF | C21 H28 Ir N O7 | C 1 c 1 | 16.9384; 8.0768; 16.2652 90; 95.124; 90 | 2216.3 | Qiao-Wen Chang; Chang-Yi Hu; Jia-Lin Chen; Qing-Song Ye; Xi-Zhu Chen; Li-Qiao Chen; Yao Yu; Wei-Ping Liu Crystal structure of bis(acetylacetonato-?2O,O')-(diacetylmethanido-?C)(3-pyridylmethanol)iridium(III), Ir(C5H7O2)3(C6H7NO) Zeitschrift für Kristallographie - New Crystal Structures, 2011, 226, 355 |
| 8103226 | CIF | C15 H12 Cl2 N2 O3 | C 1 c 1 | 10.8451; 12.773; 10.8527 90; 96.688; 90 | 1493.1 | Zhe Hong; Xiao-Xu Xu; Yan Yu; Peng Liang Crystal structure of 2-methoxy-N'-(3,5-dichloro-2-hydroxybenzylidene)benzohydrazide, C15H12Cl2N2O3 Zeitschrift für Kristallographie - New Crystal Structures, 2011, 226, 599 |
| 8103412 | CIF | Ag7 As4 Cl Cu O14 | C 1 c 1 | 10.335; 8.992; 16.546 90; 95.21; 90 | 1531.31 | Effenberger, H.; Pertlik, F. Crystal structure of Ag5Cu(AsO4)(As2O7) and Ag7Cu(As2O7)2Cl with a survey on pyroarsenate anions Zeitschrift fuer Kristallographie (149,1979-), 1993, 207, 223-236 |
| 8103540 | CIF | Ge S4 Tl4 | C 1 c 1 | 12.501; 11.248; 7.608 90; 112.21; 90 | 990.398 | Eulenberger, G. Die Kristallstruktur des Thallium(I)thiogermanats Tl4 Ge S4 Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (145,1977-148,1979), 1977, 145, 427-436 |
| 8103675 | CIF | Ba H2 N6 O | C 1 c 1 | 7.29; 10.84; 6.96 90; 104.7; 90 | 532.001 | Walitzi, E.M.; Krischner, H. Die Kristallstruktur von Bariumazidmonohydrat, Ba (N3)2 H2 O Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1973, 137, 368-379 |
| 8103828 | CIF | C3 H16 N8 Ni O7 | C 1 c 1 | 12.129; 10.858; 10.255 90; 121.1; 90 | 1156.43 | Braibanti, A.; Manotti Lanfredi, A.M.; Tiripicchio, A. The crystal and molecular structure of hydrazinium tris(hydrazincarboxylato-N,O)niccolate(II) monohydrate Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1967, 124, 335-351 |
| 8103837 | CIF | Al Ca2 Na5 O16 P4 | C 1 c 1 | 11.071; 13.951; 10.511 90; 119.34; 90 | 1415.2 | Alkemper, J.; Paulus, H.; Fuess, H. Crystal structure of aluminium dicalcium pentasodium tetrakis(phosphate), Na5 Ca2 Al (P O4)4 Zeitschrift fuer Kristallographie (149,1979-), 1994, 209, 76-76 |
| 8104012 | CIF | H10 Mn N Na O10 P2 | C 1 c 1 | 10.1124; 16.4448; 5.6 90; 104.304; 90 | 902.389 | Capitelli, F.; Brouzi, K.; Harcharras, M.; Moliterni, A.G.G.; Ennaciri, A.; Bertolasi, V. Two new ammonium diphosphates: crystal structure of Mn0.5 N H4 H2 P2 O7 * (H2 O) and Mn Na N H4 P2 O7 *3(H2 O) Zeitschrift fuer Kristallographie (149,1979-), 2004, 219, 93-98 |
| 8104168 | CIF | Cl4 H10 O5 Pt | C 1 c 1 | 7.86; 11.386; 11.292 90; 101.96; 90 | 988.629 | Rau, F.; Klement, U.; Range, K.J. Crystal structure of trans-diaquatetrachloroplatinum(IV) trihydrate, Pt (H2 O)2 Cl4 (H2 O)3 Zeitschrift fuer Kristallographie (149,1979-), 1995, 210, 606-606 |
| 8104295 | CIF | K2 O6 S4 | C 1 c 1 | 22.093; 8; 10.109 90; 102.25; 90 | 1746.02 | Christidis, P.C.; Rentzeperis, P.J.; Kirfel, A.; Will, G. Experimental charge density in polythionate anions: Part II X-ray study of the electron density distribution in potassium tetrathionate, K2 S4 O6 Zeitschrift fuer Kristallographie (149,1979-), 1989, 188, 31-42 |
| 8104392 | CIF | Ba2 H6 N18 Ni O3 | C 1 c 1 | 10.624; 9.359; 16.275 90; 110.72; 90 | 1513.56 | Walitzi, E. M.; Saracoglu, A. I.; Krischner, H. Die Kristallstruktur von Ba~2~Ni(N~3~)~6~ (H~2~O)~3~ Zeitschrift fuer Kristallographie (149,1979-), 1984, 166, 257-261 |
| 8104574 | CIF | C184 H176 F56 I8 N16 O32 S8 | C 1 c 1 | 19.762; 24.69; 12.106 90; 113.696; 90 | 5408.8 | Luo, Juan; Wang, Jie; Qiu, Gao-Yan; Xiong, Wan-Ming; Peng, Da-Yong Crystal structure of 3-iodo-N 2-(2-methyl-1-(methylsulfonyl)propan-2-yl)-N 1-(2-methyl-4-(perfluoropropan-2-yl)phenyl)phthalamide, C23H22F7I1N2O4S1 Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 1235-1238 |
| 8104643 | CIF | C11 H16 Br2 N4 O2 Zn | C 1 c 1 | 15.534; 7.956; 14.589 90; 119.094; 90 | 1575.5 | Liu, Pengju; Wang, Zongwei; Guo, Libing; Tang, Junming Crystal structure of dibromido-(1-methyl-1H-imidazole-κ1 N)-(3-(3-methyl-1H-imidazol-3-ium-1-yl)propanoato-κ1 O)zinc(II), C11H16Br2N4O2Zn Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 981-983 |
| 8105023 | CIF | C27 H24 F6 N3 O P | C 1 c 1 | 18.0589; 12.51; 13.3659 90; 124.522; 90 | 2487.9 | Jiewei, Luo; Shilu, Zhang; Yiming, Liu; Bo, Zhao The crystal structure of 3-benzyl-1-((8-(benzyloxy)quinolin-2-yl)methyl)-1H-imidazol-3-ium hexafluorophosphate, C27H24N3OF6P Zeitschrift für Kristallographie - New Crystal Structures, 2019, 235, 79-80 |
| 8105047 | CIF | C6 H15 N O5 S | C 1 c 1 | 15.167; 6.422; 10.969 90; 117.407; 90 | 948.5 | Wang, Baogang; Man, Xiaxia Crystal structure of 2-(bis(2-hydroxyethyl)ammonio)ethane-1-sulfonate, C6H15NO5S Zeitschrift für Kristallographie - New Crystal Structures, 2019, 235, 167-168 |
| 8105198 | CIF | C18 H18 Br N3 O4 S | C 1 c 1 | 10.8839; 14.2825; 13.0717 90; 108.618; 90 | 1925.6 | Feng, Yunqian; Ye, Jianghai; Wang, Peng; Tai, Shuqiong; Lang, Tianqiong The crystal structure of (Z)-2-(4-(4-bromophenyl)thiazol-2-yl)-4-(3-hydroxybut-2-enoyl)-5-methyl -1,2-dihydro-3H-pyrazol-3-one – methanol (1/1), C18H18N3O4S Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 261-263 |
| 8105606 | CIF | C15 H10 N2 O2 S | C 1 c 1 | 10.7988; 15.7684; 8.5906 90; 112.302; 90 | 1353.38 | Xing, Ai-Ping; Zeng, Dai; Zhang, Shu-Ling; Guo, Da-Feng; Chu, Yi-Xin Crystal structure of 3-(benzo[d]thiazol-2-ylamino)isobenzofuran-1(3H)-one, C15H10N2O2S Zeitschrift für Kristallographie - New Crystal Structures, 2019, 234, 247-248 |
| 8105618 | CIF | C11 H12 N4 O2 | C 1 c 1 | 16.146; 14.653; 14.621 90; 106.052; 90 | 3324.3 | Feng, Zhiqiang; Liu, Yujie; He, Yuxuan; Sha, Wenjing; Tang, Jie Crystal structure of ethyl 5-amino-1-(pyridin-2-yl)-1H-pyrazole-4-carboxylate, C11H12N4O2 Zeitschrift für Kristallographie - New Crystal Structures, 2019, 234, 281-283 |
| 8105630 | CIF | C24 H26 Cd Cl2 N10 | C 1 c 1 | 9.3081; 11.7526; 24.9876 90; 94.184; 90 | 2726.22 | Wang, Xia; Ling, Ning; Yang, Jing; Song, Ning Crystal structure of dichlorido bis[1-((2,4-dimethyl-1H-imidazol-1-yl)methyl)-1H-benzo[d][1,2,3]triazole-κN]cadmium(II), Cd(C12H13N5)2Cl2 Zeitschrift für Kristallographie - New Crystal Structures, 2019, 234, 321-323 |
| 8105634 | CIF | C15 H6 Cl6 O4 | C 1 c 1 | 12.098; 10.0628; 15.1518 90; 104.231; 90 | 1788 | Yun-Lian, Shi; Tao, Huang; Xu-Liang, Nie; Da-Yong, Peng; Jin-Chuan, Liu; Bao-Tong, Li Crystal structure of bis(2,4,6-trichlorophenyl) malonate, C15H6Cl6O4 Zeitschrift für Kristallographie - New Crystal Structures, 2019, 234, 331-332 |
| 8105745 | CIF | C14 H19 N O3 | C 1 c 1 | 11.1235; 15.3724; 8.111 90; 109.398; 90 | 1308.21 | Zhang, Jingxiao; Zhao, Xiaoxiao; Cai, Chenyu The crystal structure of N-cyclohexyl-3-hydroxy-4-methoxybenzamide, C14H19NO3 Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 543-545 |
| 8105747 | CIF | C13 H17 N O3 | C 1 c 1 | 11.6502; 13.8752; 7.9644 90; 106.051; 90 | 1237.25 | Zhang, Jingxiao; Guo, Shubin; Guo, Yongnan; Yang, Yanliang The crystal structure of N-cyclopentyl-3-hydroxy-4-methoxybenzamide, C13H17NO3 Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 551-553 |
| 8106042 | CIF | C55 H126 N14 O22 | C 1 c 1 | 44.1382; 8.1854; 21.8699 90; 109.207; 90 | 7461.53 | Zai, Yanbing; Zhu, Linlin; Wu, Xiangxiang Crystal structure of the salt tris(guanidinium) tris(tetrapropylammonium) bis(pyridine-2,4,6-tricarboxylate) – water (1/10), C55H126N14O22 Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 57-60 |
| 8106044 | CIF | C68 H54 Co2 N8 O15 S2 | C 1 c 1 | 23.7684; 13.5683; 10.0223 90; 94.405; 90 | 3222.6 | Li, Wei; Sun, Xuan; Suo, Jian; Xing, Yanpeng; Wang, Daguang Crystal structure of poly{[μ2-1,1′-(sulfonylbis(4,1-phenylene))bis(2-methyl-1H-imidazole)-κ2 N:N′][μ2-4,4′-oxydibenzoato-κ2 O:O′]cobalt(II)} hemihydrate, C34H27N4O7.5SCo Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 65-66 |
| 8106097 | CIF | C24 H32 Cu N4 O4 | C 1 c 1 | 11.8142; 45.481; 9.254 90; 97.886; 90 | 4925.4 | Wang, Wan-Wan; Wu, Wei-Na; Wang, Yuan Crystal structure of bis(5,5′-((butane-1,4-diylbis(azanylylidene))bis(methanylylidene))bis(3-(ethoxycarbonyl)-2,4-dimethylpyrrol-1-ido-k4 N,N′,N′′,N′′′)copper(II), C24H32CuN4O4 Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 195-197 |
| 8106101 | CIF | C26 H26 Cl2 Cu N2 O7 | C 1 c 1 | 17.225; 14.918; 11.589 90; 118.957; 90 | 2605.6 | Gao, Xiaoli; Zhu, Kai; Wang, Wenmin; Lu, Liping The crystal structure of catena-poly[aquachlorido(3,3′-([4,4′-bipyridine]-1,1′-diium-1,1′-diylbis(methylene))dibenzoato-κ2 O:O′)copper(II)] chloride dihydrate, C26H26Cl2CuN2O7 Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 209-211 |
| 8106244 | CIF | C19 H21 F N2 O2 | C 1 c 1 | 14.337; 15.549; 8.0212 90; 103.33; 90 | 1740 | Ikram, Muhammad; Khan, Momin; Ahmad, Sajjad; Rehman, Sadia; Schulzke, Carola The crystal structure of 4-tert-butyl-N′-[(E)-(4-fluoro-3-methoxyphenyl)methylidene]benzohydrazide, C19H21F1N2O2 Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 643-645 |
| 8106417 | CIF | C28 H19 N5 O2 | C 1 c 1 | 13.9896; 21.9561; 7.1643 90; 91.782; 90 | 2199.5 | El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Hegazy, Amany S.; Alamri, Mesfer; Kariuki, Benson M. Crystal structure of 2-((3-(5-methyl-1-phenyl-1H-1,2,3-triazol-4-yl)-1-phenyl-1H-pyrazol-4-yl)methylene)-1H-indene-1,3(2H)-dione, C28H19N5O2 Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 19-20 |
| 8106487 | CIF | C6 H4 Cl N3 O4 | C 1 c 1 | 14.1945; 8.1107; 15.3834 90; 115.472; 90 | 1598.9 | Jianlong, Wang; Tianbei, Zhang; Lizhen, Chen The crystal structure of 4-chloro-3,5-dinitroaniline, C6H4ClN3O4 Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 215-216 |
| 8106493 | CIF | C15 H13 N O3 | C 1 c 1 | 3.923; 26.578; 11.7147 90; 94.028; 90 | 1218.42 | Radi, Smaail; Tighadouini, Said; Eddike, Driss; Mabkhot, Yahia N.; Tillard, Monique Crystal structure of (Z)-3-hydroxy-3-(4-methoxyphenyl)-1-(pyridin-2-yl)prop-2-en-1-one, C15H13NO3 Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 235-236 |
| 8106526 | CIF | C10 H14 N2 O | C 1 c 1 | 6.8354; 13.8221; 10.2905 90; 90.625; 90 | 972.2 | El-Hiti, Gamal A.; Smith, Keith; Hegazy, Amany S.; Kariuki, Benson M. Crystal structure of 1,1-dimethyl-3-(4-methylphenyl)urea, C10H14N2O Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 329-330 |
| 8106742 | CIF | C27 H29 Br Cu N2 O2 P | C 1 c 1 | 15.5806; 10.5071; 16.9748 90; 110.729; 90 | 2599 | Fettouhi, Mohammed Crystal structure of bromido(4,4′-dimethoxy-2,2′-bipyridine-κ2 N,N′)(isopropyl(diphenyl)phosphane-κP)copper(I), C27H29BrCuN2O2P Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 985-986 |
| 8107591 | CIF | C6 H12 N4 O4 | C 1 c 1 | 9.8171; 16.1119; 6.9125 90; 121.443; 90 | 932.81 | Cong, Chen; Ruxin, Zhang; Shiyu, Li; Lizhen, Chen; Jianlong, Wang The crystal structure of N,N′-((nitroazanediyl)bis(methylene))diacetamide, C6H12O4N4 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 885-886 |
| 8107607 | CIF | C18 H17 N O3 S | C 1 c 1 | 32.036; 7.2154; 7.4283 90; 99.943; 90 | 1691.3 | Shi, Chengzhe; Chen, Xinlei; Jin, Shouwen; Chen, Shiyi; Wang, Daqi The crystal structure of 4-aminiumbiphenyl benzenesulfonate, C18H17NO3S Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 945-947 |
| 9000009 | CIF | H2 Mg3 O12 Si4 | C 1 c 1 | 5.31; 9.2; 28.46 90; 97.14; 90 | 1379.55 | Gruner, J. W. The structures of vermiculites and their collapse by dehydration American Mineralogist, 1934, 19, 557-575 |
| 9000016 | CIF | H2 Mg3 O12 Si4 | C 1 c 1 | 5.33; 9.18; 28.85 90; 93.25; 90 | 1409.34 | Hendricks, S. B.; Jefferson, M. E. Crystal structure of vermiculites and mixed vermiculite-chlorites American Mineralogist, 1938, 23, 851-862 |
| 9000024 | CIF | Al F H K Mg3 O11 Si3 | C 1 c 1 | 9.2; 5.3; 60 90; 90; 90 | 2925.6 | Hendricks, S. B.; Jefferson, M. E. Polymorphism of the micas with optical measurements American Mineralogist, 1939, 24, 729-771 |
| 9000060 | CIF | Al0.721 Fe0.24 H3 Mg1.338 O9 Si1.36 | C 1 c 1 | 5.33; 9.18; 28.9 90; 97; 90 | 1403.52 | Mathieson, A. M.; Walker, G. F. Crystal structure of magnesium-vermiculite American Mineralogist, 1954, 39, 231-255 |
| 9000122 | CIF | Al2 H4 O9 Si2 | C 1 c 1 | 5.15; 8.94; 14.736 90; 103.58; 90 | 659.492 | Bailey, S. W. Polymorphism of the kaolin minerals American Mineralogist, 1963, 48, 1196-1209 |
| 9000289 | CIF | As Ca F Mg O4 | C 1 c 1 | 6.688; 8.944; 7.57 90; 121.17; 90 | 387.447 | Bladh, K. W.; Corbett, R. K.; McLean, W. J.; Laughon, R. B. The crystal structure of tilasite American Mineralogist, 1972, 57, 1880-1884 |
| 9000409 | CIF | Fe0.01 Mn Nb0.3 O8 Sn0.47 Ta2.12 | C 1 c 1 | 9.53; 11.49; 5.098 90; 91.21; 90 | 558.105 | Graham, J.; Thornber, M. R. The crystal chemistry of complex niobium and tantalum oxides II. Composition and structure of wodginite from Wodgina, Australia American Mineralogist, 1974, 59, 1040-1044 |
| 9000466 | CIF | Al4 Ca H2 O12 Si2 | C 1 c 1 | 5.1038; 8.8287; 19.148 90; 95.46; 90 | 858.893 | Guggenheim, S.; Bailey, S. W. Refinement of the margarite structure in subgroup symmetry American Mineralogist, 1975, 60, 1023-1029 |
| 9000520 | CIF | O2 Si | C 1 c 1 | 18.524; 5.0032; 23.81 90; 105.82; 90 | 2123.11 | Dollase, W. A.; Baur, W. H. The superstructure of meteoritic low tridymite solved by computer simulation American Mineralogist, 1976, 61, 971-978 |
| 9000604 | CIF | Al4 Ca H2 O12 Si2 | C 1 c 1 | 5.104; 8.829; 19.148 90; 95.5; 90 | 858.898 | Guggenheim, S.; Bailey, S. W. Refinement of the margarite structure in subgroup symmetry: correction, further refinement, and comments American Mineralogist, 1978, 63, 186-187 |
| 9000653 | CIF | Ca H4 O6 P0.5 S0.5 | C 1 c 1 | 5.721; 30.992; 6.25 90; 117.26; 90 | 985.083 | Sakae, T.; Nagata, H.; Sudo, T. The crystal structure of synthetic calcium phosphate - sulfate hydrate, Ca2HPO4SO4.4H2O, and its relation to brushite and gypsum American Mineralogist, 1978, 63, 520-527 |
| 9000869 | CIF | Al3.68 Be0.58 Ca H2 Li0.5 O12 Si1.74 | C 1 c 1 | 5.058; 8.763; 19.111 90; 95.39; 90 | 843.316 | Lin, J. C.; Guggenheim, S. The crystal structure of a Li,Be-rich brittle mica: a dioctahedral-trioctahedral intermediate American Mineralogist, 1983, 68, 130-142 |
| 9001889 | CIF | Al4.99 H8 Li0.86 O18 Si3.04 | C 1 c 1 | 5.158; 8.94; 28.498 90; 96.6; 90 | 1305.41 | Zheng, H.; Bailey, S. W. Refinement of the cookeite "r" structure American Mineralogist, 1997, 82, 1007-1013 |
| 9002265 | CIF | C3 Ca0.977 Ce2.023 F2 O9 | C 1 c 1 | 12.3049; 7.1056; 28.2478 90; 98.2416; 90 | 2444.3 | Ni, Y.; Post, J. E.; Hughes, J. M. The crystal structure of parisite-(Ce), Ce2CaF(CO3)3 sample: from Muso Mine, Columbia American Mineralogist, 2000, 85, 251-258 |
| 9003081 | CIF | Al2 H4 O9 Si2 | C 1 c 1 | 5.161; 8.96; 14.459 90; 96.77; 90 | 663.959 | Dera, P.; Prewitt, C. T.; Japel, S.; Bish, D. L.; Johnston, C. T. Pressure-controlled polytypism in hydrous layered materials Sample: Low pressure dickite at P = 0.1 MPa American Mineralogist, 2003, 88, 1428-1435 |
| 9003082 | CIF | Al2 H4 O9 Si2 | C 1 c 1 | 5.082; 8.757; 13.771 90; 89.6; 90 | 612.837 | Dera, P.; Prewitt, C. T.; Japel, S.; Bish, D. L.; Johnston, C. T. Pressure-controlled polytypism in hydrous layered materials Sample: High pressure dickite at P = 4.1 GPa American Mineralogist, 2003, 88, 1428-1435 |
| 9003634 | CIF | Al2 H6 Na2 O13 Si3 | C 1 c 1 | 6.48; 19.293; 9.8984 90; 107.56; 90 | 1179.82 | Lee, Y.; Hriljac, J. A.; Parise, J. B.; Vogt, T. Pressure-induced stabilization of ordered paranatrolite: A new insight into the paranatrolite controversy Sample: at P = 0.99 GPa American Mineralogist, 2005, 90, 252-257 |
| 9003883 | CIF | Al2.315 Ca0.474 H2.03 Na1.462 O13 Si2.685 | C 1 c 1 | 6.58; 19.002; 9.936 90; 108.97; 90 | 1174.86 | Lee, Y.; Hriljac, J. A.; Parise, J. B.; Vogt, T. Pressure-induced hydration in zeolite tetranatrolite Note: P = 0.4 GPa American Mineralogist, 2006, 91, 247-251 |
| 9003884 | CIF | Al2.315 Ca0.474 H2.02 Na1.462 O13 Si2.685 | C 1 c 1 | 6.567; 18.963; 9.975 90; 108.49; 90 | 1178.06 | Lee, Y.; Hriljac, J. A.; Parise, J. B.; Vogt, T. Pressure-induced hydration in zeolite tetranatrolite Note: P = 0.8 GPa American Mineralogist, 2006, 91, 247-251 |
| 9003885 | CIF | Al2.315 Ca0.474 H2.02 Na1.462 O13 Si2.685 | C 1 c 1 | 6.556; 18.95; 9.972 90; 108.47; 90 | 1175.07 | Lee, Y.; Hriljac, J. A.; Parise, J. B.; Vogt, T. Pressure-induced hydration in zeolite tetranatrolite Note: P = 1.1 GPa American Mineralogist, 2006, 91, 247-251 |
| 9003886 | CIF | Al2.315 Ca0.474 H2.02 Na1.462 O13 Si2.685 | C 1 c 1 | 6.512; 18.85; 9.901 90; 108.73; 90 | 1151 | Lee, Y.; Hriljac, J. A.; Parise, J. B.; Vogt, T. Pressure-induced hydration in zeolite tetranatrolite Note: P = 2.5 GPa American Mineralogist, 2006, 91, 247-251 |
| 9004545 | CIF | Al0.74 As3 Fe1.26 H23 Mg4.23 Mn8.06 O34 Zn0.71 | C 1 c 1 | 14.236; 8.206; 24.225 90; 93.52; 90 | 2824.64 | Cooper, M. A.; Hawthorne, F. C. The effect of differences in coordination on ordering of polyvalent cations in close-packed structures: The crystal structure of arakiite and comparison with hematolite The Canadian Mineralogist, 1999, 37, 1471-1482 |
| 9005118 | CIF | Be3 Ca H12 O14 P2 | C 1 c 1 | 11.897; 9.707; 9.633 90; 95.76; 90 | 1106.84 | Walter, F. Weinebeneite, CaBe3(PO4)2(OH)2.4H2O, a new mineral species: mineral data and crystal structure European Journal of Mineralogy, 1992, 4, 1275-1283 |
| 9005270 | CIF | O2 Si | C 1 c 1 | 5.007; 8.6004; 8.2169 90; 91.512; 90 | 353.715 | Graetsch, H.; Topalovic-Dierdorf I 29Si MAS NMR spectrum and superstructure of modulated tridymite L3-To(MX-1) Sample: average crystal structure European Journal of Mineralogy, 1996, 8, 103-113 |
| 9005285 | CIF | Al1.79 F0.91 Fe1.334 H1.09 K0.978 Li0.486 O11.09 Si3.11 | C 1 c 1 | 5.292; 9.187; 19.935 90; 95.4; 90 | 964.891 | Rieder, M.; Hybler, J.; Smrcok, L.; Weiss, Z. Refinement of the crystal structure of zinnwaldite 2M_1 European Journal of Mineralogy, 1996, 8, 1241-1248 |
| 9005446 | CIF | Ca5 H10 O22 Si6 | C 1 c 1 | 11.276; 7.343; 22.642 90; 97.28; 90 | 1859.64 | Merlino, S.; Bonaccorsi, E.; Armbruster, T. The real structure of clinotobermorite and tobermorite 9 A: OD character, polytypes, and structural relationships Sample: MDO1 data collected at Pisa European Journal of Mineralogy, 2000, 12, 411-429 |
| 9005545 | CIF | Al2 Ca H6 O13 Si3 | C 1 c 1 | 6.533; 19.03; 9.83 90; 109.95; 90 | 1148.76 | Comodi, P.; Gatta, G. D.; Zanazzi, P. F. High-pressure structural behaviour of scolecite Sample: P = .0001 GPa European Journal of Mineralogy, 2002, 14, 567-574 |
| 9005546 | CIF | Al2 Ca H6 O13 Si3 | C 1 c 1 | 6.471; 18.804; 9.723 90; 109.79; 90 | 1113.23 | Comodi, P.; Gatta, G. D.; Zanazzi, P. F. High-pressure structural behaviour of scolecite Sample: P = 1.77 GPa European Journal of Mineralogy, 2002, 14, 567-574 |
| 9005547 | CIF | Al2 Ca H6 O13 Si3 | C 1 c 1 | 6.43; 18.631; 9.363 90; 109.6; 90 | 1056.67 | Comodi, P.; Gatta, G. D.; Zanazzi, P. F. High-pressure structural behaviour of scolecite Sample: P = 3.38 GPa European Journal of Mineralogy, 2002, 14, 567-574 |
| 9005548 | CIF | Al2 Ca H6 O13 Si3 | C 1 c 1 | 6.542; 18.842; 9.863 90; 109.89; 90 | 1143.23 | Comodi, P.; Gatta, G. D.; Zanazzi, P. F. High-pressure structural behaviour of scolecite Sample: P = .0001 GPa (after compression) Note: y-coordinate of O5 altered to match bond lengths European Journal of Mineralogy, 2002, 14, 567-574 |
| 9005948 | CIF | Fe2 K Li Na2 O24 Si8 Ti2 | C 1 c 1 | 16.436; 12.436; 9.966 90; 115.63; 90 | 1836.6 | Kunz, M.; Armbruster, T.; Lager, G. A.; Schultz, A. J.; Goyette, R. J.; Lottermoser, W.; Amthauer, G. Fe, Ti ordering and octahedral distortions in acentric neptunite: temperature dependent X-ray and neutron structure refinements and Mossbauer Spectroscopy Sample: T = 15 K Physics and Chemistry of Minerals, 1991, 18, 199-213 |
| 9005949 | CIF | Fe2 K Li Na2 O24 Si8 Ti2 | C 1 c 1 | 16.43; 12.436; 9.963 90; 115.6; 90 | 1835.84 | Kunz, M.; Armbruster, T.; Lager, G. A.; Schultz, A. J.; Goyette, R. J.; Lottermoser, W.; Amthauer, G. Fe, Ti ordering and octahedral distortions in acentric neptunite: temperature dependent X-ray and neutron structure refinements and Mossbauer Spectroscopy Sample: T = 110 K Physics and Chemistry of Minerals, 1991, 18, 199-213 |
| 9005950 | CIF | Fe2 K Li Na2 O24 Si8 Ti2 | C 1 c 1 | 16.427; 12.478; 9.975 90; 115.56; 90 | 1844.54 | Kunz, M.; Armbruster, T.; Lager, G. A.; Schultz, A. J.; Goyette, R. J.; Lottermoser, W.; Amthauer, G. Fe, Ti ordering and octahedral distortions in acentric neptunite: temperature dependent X-ray and neutron structure refinements and Mossbauer Spectroscopy Sample: T = 293 K Physics and Chemistry of Minerals, 1991, 18, 199-213 |
| 9005951 | CIF | Fe2 K Li Na2 O24 Si8 Ti2 | C 1 c 1 | 16.426; 12.532; 9.995 90; 115.51; 90 | 1856.89 | Kunz, M.; Armbruster, T.; Lager, G. A.; Schultz, A. J.; Goyette, R. J.; Lottermoser, W.; Amthauer, G. Fe, Ti ordering and octahedral distortions in acentric neptunite: temperature dependent X-ray and neutron structure refinements and Mossbauer Spectroscopy Sample: T = 493 K Physics and Chemistry of Minerals, 1991, 18, 199-213 |
| 9006299 | CIF | O2 Si | C 1 c 1 | 6.6395; 8.0488; 5.4184 90; 99.9967; 90 | 285.163 | Boisen, M. B.; Gibbs, G. V.; Bukowinski, M. S. T. Framework silica structures generated using simulated annealing with a potential energy function based on an H6Si2O7 molecule Sample: 16 Physics and Chemistry of Minerals, 1994, 21, 269-284 |
| 9007428 | CIF | Ca3 H6 O10 Si2 | C 1 c 1 | 16.27; 5.632; 13.23 90; 134.8; 90 | 860.212 | Megaw, H. D. The structure of afwillite, Ca3(SiO3OH)2*2H2O Acta Crystallographica, 1952, 5, 477-491 |
| 9007478 | CIF | Ag S2 Sb | C 1 c 1 | 12.862; 4.411; 13.22 90; 98.63; 90 | 741.535 | Knowles, C. R. A redetermination of the structure of miargyrite, AgSbS2 Acta Crystallographica, 1964, 17, 847-851 |
| 9007501 | CIF | Cu H6 O7 S | C 1 c 1 | 5.592; 13.029; 7.341 90; 97.05; 90 | 530.808 | Zahrobsky, R. F.; Baur, W. H. On the crystal chemistry of salt hydrates. V. The determination of the crystal structure of CuSO4*3H2O (bonattite) Locality: synthetic Acta Crystallographica, Section B, 1968, 24, 508-513 |
| 9007611 | CIF | Ca3 H6 O10 Si2 | C 1 c 1 | 16.278; 5.6321; 13.236 90; 134.898; 90 | 859.577 | Malik, K. M. A.; Jeffery, J. W. A re-investigation of the structure of afwillite Acta Crystallographica, Section B, 1976, 32, 475-480 |
| 9008260 | CIF | Ca H2 O5 Si Zn | C 1 c 1 | 5.09; 15.829; 5.386 90; 103.26; 90 | 422.379 | Venetopoulos, C. C.; Rentzeperis, P. J. Redetermination of the crystal structure of clinohedrite, CaZnSiO4*H2O Zeitschrift fur Kristallographie, 1976, 144, 377-392 |
| 9009235 | CIF | Al2 H4 O9 Si2 | C 1 c 1 | 8.906; 5.146; 15.664 90; 113.58; 90 | 657.944 | Zheng, H.; Bailey, S. W. Refinement of the nacrite structure Clays and Clay Minerals, 1994, 42, 46-52 |
| 9010069 | CIF | Al Ca0.91 F0.03 Fe9.18 H2.97 K0.83 Mg2.8 Mn1.02 Na5.01 O50 P12 Sr0.01 | C 1 c 1 | 16.552; 10.0529; 24.6477 90; 106.509; 90 | 3932.19 | Camara, F.; Oberti, R.; Chopin, C.; Medenbach, O. The arrojadite enigma: I. A new formula and a new model for the arrojadite structure Sample: Rapid Creek, Yukon, Canada American Mineralogist, 2006, 91, 1249-1259 |
| 9010070 | CIF | Al Ba0.2 Ca0.59 F0.9 Fe6.61 H2.1 K0.03 Mg3.6 Mn3.39 Na2.94 O49.1 P12 Pb0.03 Sr0.93 | C 1 c 1 | 16.3992; 9.94; 24.4434 90; 105.489; 90 | 3839.76 | Camara, F.; Oberti, R.; Chopin, C.; Medenbach, O. The arrojadite enigma: I. A new formula and a new model for the arrojadite structure Sample: Horrsjoberg, Varmland, Sweden American Mineralogist, 2006, 91, 1249-1259 |
| 9010071 | CIF | Al Ba0.01 Ca0.51 F0.03 Fe3.8 H1.97 K0.5 Li0.3 Mn9.7 Na4.92 O50 P12 Pb0.01 Sr0.05 | C 1 c 1 | 16.69; 10.1013; 24.8752 90; 105.616; 90 | 4038.93 | Camara, F.; Oberti, R.; Chopin, C.; Medenbach, O. The arrojadite enigma: I. A new formula and a new model for the arrojadite structure Sample: Branchville, Connecticut, USA American Mineralogist, 2006, 91, 1249-1259 |
| 9010435 | CIF | Al0.09 Ca0.87 Fe1.91 H15.72 Na1.13 O29 P4 U1.888 | C 1 c 1 | 19.6441; 7.0958; 18.7029 90; 115.692; 90 | 2349.27 | Mills, S. J.; Birch, W. D.; Kolitsch, U.; Mumme, W. G.; Grey, I. E. Lakebogaite, CaNaFe3+2H(UO2)2(PO4)4(OH)2(H2O)8, a new uranyl phosphate with a unique crystal structure from Victoria, Australia Locality: Upper Devonian granite, near Lake Boga, northern Victoria, Australia American Mineralogist, 2008, 93, 691-697 |
| 9010631 | CIF | C2 Al1.3 Ba3 Cl1.24 O14 Si2.7 | C 1 c 1 | 31.2329; 5.2398; 9.0966 90; 106.933; 90 | 1424.16 | Basciano, L. C.; Groat, L. A. The crystal structure of kampfite The Canadian Mineralogist, 2007, 45, 935-943 |
| 9010659 | CIF | C6 H6 Ba2.79 Ca0.95 Ce0.13 Na1.07 O21 Sr0.31 Y0.74 | C 1 c 1 | 15.8213; 9.1364; 13.7522 90; 112.44; 90 | 1837.35 | Demartin, F.; Gramaccioli, C. M.; Campostrini, I.; Diella, V. The crystal structure of mckelveyite-(Y)-2M, a new monoclinic polytype from Val Malenco, Italian Alps Locality: "Cava Fabi," talc quarry near Lanzada, Val Malenco, Lombardy, Italy The Canadian Mineralogist, 2008, 46, 195-203 |
| 9011102 | CIF | C H20 Na2 O13 | C 1 c 1 | 12.83; 9.026; 13.44 90; 123; 90 | 1305.31 | Taga, T. Crystal structure of Na2CO3*10H2O Acta Crystallographica, Section B, 1969, 25, 2656-2657 |
| 9011882 | CIF | C3 Ca1.361 Dy0.02 F0.987 Fe0.06 Mn0.439 Na3 O9 Y0.034 | C 1 c 1 | 8.012; 15.79; 7.019 90; 100.78; 90 | 872.3 | Yamnova, N. A.; Pushcharovskii D Yu; Khomyakov, A. P.; Vyatkin, S. V. Crystal structure of the new natural fluorocarbonate Na3Ca(Mn,Ca)(CO3)3F Soviet Physics - Crystallography, 1991, 36, 14-16 |
| 9011893 | CIF | Be2 H4 Na4 O20 Si6 Sn | C 1 c 1 | 20.78; 7.45; 12.05 90; 117.1; 90 | 1660.67 | Maksimova, N. V.; Ilyukhin, V. V.; Belov, N. V. Crystal structure of sorensenite Soviet Physics Doklady, 1974, 18, 681-682 |
| 9012520 | CIF | H8 O14 P2 Sr V2 | C 1 c 1 | 9.026; 9.01; 12.841 90; 100.19; 90 | 1027.81 | Kang, H. Y.; Lee, W. C.; Wang, S. L. Hydrothermal synthesis and structural characterization of four layered vanadyl(IV) phosphate hydrates A(VO)2(PO4)2*4H2O (A=Co,Ca,Sr,Pb) Inorganic Chemistry, 1992, 31, 4743-4748 |
| 9012521 | CIF | H6 O14 P2 Pb V2 | C 1 c 1 | 9.03; 9.021; 12.874 90; 100.16; 90 | 1032.27 | Kang, H. Y.; Lee, W. C.; Wang, S. L. Hydrothermal synthesis and structural characterization of four layered vanadyl(IV) phosphate hydrates A(VO)2(PO4)2*4H2O (A=Co,Ca,Sr,Pb) Inorganic Chemistry, 1992, 31, 4743-4748 |
| 9012547 | CIF | H3 Na O5 S | C 1 c 1 | 7.799; 7.79; 8.23 90; 119.95; 90 | 433.237 | Grimvall, S. The crystal structure of NaHSO4H2O Acta Chemica Scandinavica, 1971, 25, 3213-3219 |
| 9012666 | CIF | Al2 H4 O9 Si2 | C 1 c 1 | 8.91; 5.144; 14.593 90; 100.5; 90 | 657.642 | Zhukhlistov, A. P. Crystal structure of nacrite from the electron diffraction data Crystallography Reports, 2008, 53, 76-82 |
| 9012778 | CIF | Fe2 K Li Na2 O24 Si8 Ti2 | C 1 c 1 | 16.4821; 12.5195; 10.0292 90; 115.474; 90 | 1868.31 | Zolotarev, A. A.; Krivovichev, S. V.; Yakovenchuk, V. N. Refinement of the mangan-neptunite structure Locality: synthetic Note: changed signs of z-coordinates of O12 and O14, Ti1(y) to .32364 Zapiski Vserossijskogo Mineralogicheskogo Obshchetstva, 2007, 136, 118-123 |
| 9012818 | CIF | O6 Sn Ta2 | C 1 c 1 | 17.11299; 4.872; 5.548 90; 90.59; 90 | 462.537 | Maksimova, N. V.; Ilyukhin, V. V.; Belov, N. V. Crystal structure of thoreaulite, SaTa2O6 Soviet Physics Doklady, 1975, 20, 528-529 |
| 9013114 | CIF | Ba0.05 K0.95 Li Mg0.431 Mn1.569 Na2 O24 Si8 Ti0.34 V1.66 | C 1 c 1 | 16.45; 12.492; 9.995 90; 115.32; 90 | 1856.59 | Matsubara, S.; Miyawaki, R.; Kurosawa, M.; Suzuki, Y. Watatsumiite, KNa2LiMn2V2Si8O24, a new mineral from the Tanohata mine, Iwate Prefecture, Japan Locality: metamorphosed manganese ore deposit, Tanohata mine, Iwate Prefecture, Japan Journal of Mineralogical and Petrological Sciences, 2003, 98, 142-150 |
| 9013382 | CIF | Bi Br0.558 Cl5.322 Tl3 | C 1 c 1 | 26.686; 15.127; 13.014 90; 108.11; 90 | 4993.23 | Demartin, F.; Gramaccioli, C. M.; Campostrini, I. Steropesite, Tl3BiCl6, a new thallium bismuth chloride from La Fossa crater, Vulcano, Aeolian Islands, Italy Locality: La Fossa crater, Vulcano, Aeolian Islands, Italy The Canadian Mineralogist, 2009, 47, 373-380 |
| 9013704 | CIF | Fe2.747 Ni0.253 S3 | C 1 c 1 | 6.8973; 11.954; 17.602 90; 101.302; 90 | 1423.15 | De Villiers, J. P. R.; Liles, D. C. The crystal-structure and vacancy distribution in 6C pyrrhotite American Mineralogist, 2010, 95, 148-152 |
| 9013811 | CIF | Ca3.19 Ce1.22 F3 H Na2.07 Nb0.55 O15 Si4 Ti0.45 | C 1 c 1 | 7.473; 11.294; 18.778 90; 101.6; 90 | 1552.49 | Biagioni, C.; Bonaccorsi, E.; Merlino, S.; Parodi, G. C.; Perchiazzi, N.; Chevrier, V.; Bersani, D. Roumaite, (Ca,Na)3(Ca,REE,Na)4(Nb,Ti)[Si2O7]2(OH)F3, from Rouma Island, Los Archipelago, Guinea: A new mineral species related to dovyrenite The Canadian Mineralogist, 2010, 48, 17-28 |
| 9013919 | CIF | Al2 H4 O9 Si2 | C 1 c 1 | 5.1474; 8.9386; 14.39 90; 96.483; 90 | 657.858 | Bish, D. L.; Johnston, C. T. Rietveld refinement and Fourier-transform infrared spectroscopic study of the dickite structure at low temperature Note: Sample at T = 12 K Clays and Clay Minerals, 1993, 41, 297-304 |
| 9013939 | CIF | Al2 H4 O9 Si2 | C 1 c 1 | 5.1375; 8.9178; 14.389 90; 96.74; 90 | 654.679 | Joswig, W.; Drits, V. A. The orientation of the hydroxyl groups in dickite by X-ray diffraction Note: z-coordinate of Si1 altered to reproduce reported bond lengths Neues Jahrbuch fur Mineralogie, Monatshefte, 1986, 1986, 19-22 |
| 9014220 | CIF | B11 Ca0.62 H7 O22 Sr1.38 | C 1 c 1 | 6.607; 11.7125; 20.6848 90; 91.998; 90 | 1599.71 | Grice, J. D.; Pring, A. Veatchite: structural relationships of the three polytypes Note: moderate-T, high-P polytype veatchite-2M American Mineralogist, 2012, 97, 489-495 |
| 9014939 | CIF | Al Ca0.984 Fe10.54 K0.902 Mg2.46 Na4.858 O50 P12 | C 1 c 1 | 16.549; 10.053; 24.618 90; 106.55; 90 | 3925.95 | Steele, I. M. Arrojadite: variations in space group and composition based on four new refinements Sample: red06ye General Meeting of the International Mineralogical Association, 2002, 18, MO2-117 |
| 9015151 | CIF | Al Ba0.06 Ca0.23 Fe11.69 K0.68 Mg1.85 Na4.459 O50 P12 Sr0.23 | C 1 c 1 | 16.531; 10.004; 24.644 90; 105.943; 90 | 3918.77 | Steele, I. M. Arrojadite: variations in space group and composition based on four new refinements Sample: arropala General Meeting of the International Mineralogical Association, 2002, 18, MO2-117 |
| 9016057 | CIF | Cu O | C 1 c 1 | 4.6893; 3.4268; 5.1321 90; 99.653; 90 | 81.302 | Asbrink, S.; Waskowska, A. CuO: x-ray single-crystal structure determination at 196 K and room temperature Note: T = 196 K Journal of Physics: Condensed Matter, 1991, 3, 8173-8180 |
| 9016300 | CIF | Al4 Ca0.725 H1.98 Li0.105 Mg0.105 Na0.21 O12 Si2 | C 1 c 1 | 5.108; 8.844; 19.156 90; 95.48; 90 | 861.42 | Joswig, W.; Takeuchi, Y.; Fuess, H. Neutron-diffraction study on the orientation of hydroxyl groups in margarite Zeitschrift fur Kristallographie, 1983, 165, 295-303 |
| 9016326 | CIF | Cu O | C 1 c 1 | 4.6927; 3.4283; 5.137 90; 99.546; 90 | 81.5 | Asbrink, S.; Waskowska, A. CuO: x-ray single-crystal structure determination at 196 K and room temperature Note: T = room temperature Journal of Physics: Condensed Matter, 1991, 3, 8173-8180 |
| 9017298 | CIF | O2 Si | C 1 c 1 | 18.494; 4.991; 25.832 90; 117.75; 90 | 2110.15 | Kato, V. K.; Nukui, A. Die kristallstruktur des monoklinen tief-tridymits Acta Crystallographica, Section B, 1976, 32, 2486-2491 |
| 9017415 | CIF | C Ca O3 | C 1 c 1 | 12.281; 7.142; 9.371 90; 115.48; 90 | 741.993 | Demichelis, R.; Raiteri, P.; Gale, J. D.; Dovesi, R. The multiple structures of vaterite Crystal Growth & Design, 2013, 13, 2247-2251 |
| 9017531 | CIF | As Cu Pt S2 | C 1 c 1 | 3.756; 15.876; 5.852 90; 90; 90 | 348.956 | Ding, K.; He, C.; Zheng, Q. Determination of daomanite crystal structure Kexue Tongbao, 1982, 27, 62-66 |
| 9017634 | CIF | Al3.756 Be0.244 Ca0.771 H1.69 Li0.413 Na0.229 O12 Si2 | C 1 c 1 | 5.0864; 8.8186; 19.1098 90; 95.445; 90 | 853.301 | Gatta, G. D.; Nenert, G.; Guastella, G.; Lotti, P.; Guastoni, A.; Rizzato, S. A single-crystal neutron and X-ray diffraction study of a Li,Be-bearing brittle mica Note: X-ray, T = 100 K Mineralogical Magazine, 2014, 78, 55-72 |
| 9017636 | CIF | Al3.89 Be0.11 Ca0.79 H1.69 Li0.266 Na0.21 O12 Si2 | C 1 c 1 | 5.059; 8.7909; 19.0176 90; 95.459; 90 | 841.937 | Gatta, G. D.; Nenert, G.; Guastella, G.; Lotti, P.; Guastoni, A.; Rizzato, S. A single-crystal neutron and X-ray diffraction study of a Li,Be-bearing brittle mica Note: Neutron, T = 20 K Mineralogical Magazine, 2014, 78, 55-72 |
| 9017641 | CIF | Cl5 Fe2 H3 K1.746 N2.254 Na2 O12 S3 | C 1 c 1 | 18.284; 12.073; 9.535 90; 108.1; 90 | 2000.63 | Demartin, F.; Castellano, C.; Campostrini, I. Therasiaite, (NH4)3KNa2Fe2+Fe3+(SO4)3Cl5, a new sulfate chloride from La Fossa Crater, Vulcano, Aeolian islands, Italy Mineralogical Magazine, 2014, 78, 203-213 |
| 9017734 | CIF | Al Ca0.12 Fe9.1 K0.874 Mg1.1 Mn3.68 Na4.752 O50 P12 | C 1 c 1 | 16.5345; 10.04057; 24.6261 90; 105.891; 90 | 3932.08 | Lykova, I.; Rowe, R.; Poirier, G.; Helwig, K.; Friis, H. Manganoarrojadite-(KNa), KNa5MnFe13Al(PO4)11(PO3OH)(OH)2, a new arrojadite-group mineral from the Palermo No. 1 mine, New Hampshire, USA Mineralogical Magazine, 2020, 84, 932-940 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!