Crystallography Open Database
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Searching space group like 'P b c a'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 8104723 | CIF | C17 H13 B N2 O2 | P b c a | 10.082; 13.1135; 20.644 90; 90; 90 | 2729.3 | Ren, Huaping; Miao, Zong-Cheng The crystal structure of 2-(benzo[d][1,3]dioxol-5-yl)-2,3-dihydro-1H-naphtho[1,8-de][1,3,2]diazaborinine, C17H13BN2O2 Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 821-822 |
| 8104740 | CIF | C9 H8 Cu I N5 O5 | P b c a | 11.0801; 6.8489; 35.3975 90; 90; 90 | 2686.19 | Lv, Benlian Crystal structure of catena-poly[aqua-(4-iodopyridine-2,6-dicarboxylato-κ3 N,O,O′)-(μ2-4-amino-4H-1,2,4-triazole-κ2 N:N′) copper(II)], C9H8N5O5CuI Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 873-875 |
| 8104770 | CIF | C12 H14 O6 | P b c a | 18.0207; 7.6885; 18.2326 90; 90; 90 | 2526.2 | Xiong, Chun-Lan; Lan, Ying-Dong; Song, Xiu-Ying; Xiong, Wan-Ming; Nie, Xu-Liang Crystal structure of methyl 4-acetoxy-3,5-dimethoxybenzoate, C12H14O6 Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 573-575 |
| 8104790 | CIF | C33 H36 N2 O4 | P b c a | 15.3543; 14.7958; 25.496 90; 90; 90 | 5792.2 | Xu, Qin-Juan Crystal structure of N-(5-(2-(benzyl(1-(4-methoxyphenyl)propan-2-yl)amino)-1-hydroxyethyl)-2-(benzyloxy)phenyl)formamide, C33H36N2O4 Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 647-649 |
| 8104861 | CIF | C44 H52 O14 Ti2 | P b c a | 15.0005; 15.9478; 18.4438 90; 90; 90 | 4412.2 | Youzhu, Yu; Yuhua, Guo; Yongsheng, Niu; Nana, Liu; Hongfei, Zhang Crystal structure of bis(μ2-2-oxido-2-phenylacetate-κ3 O:O,O′)-bis(1-isopropoxy-2-oxo-2-phenylethan-1-olato-κ2O,O′)-bis(propan-2-olato-κ1O)dititanium(IV), C44H52O14Ti2 Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 467-469 |
| 8104872 | CIF | C60 H64 N18 O30 V10 | P b c a | 21.1781; 14.4198; 24.543 90; 90; 90 | 7495 | Cui, Chuansheng; Liu, Sen; Zhao, Wenli The crystal structure of hexakis(2-(pyridin-2-ylamino)pyridin-1-ium) decavanadate(V) dihydrate, C60H64N18O30V10 Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 25-27 |
| 8104886 | CIF | C8 H11 Cl N2 S | P b c a | 11.3126; 8.3567; 20.413 90; 90; 90 | 1929.76 | Maritz, Marius; Hosten, Eric C.; Betz, Richard Crystal structure of benzylthiouronium chloride, C8H11ClN2S Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 73-75 |
| 8104915 | CIF | C18 H20 Br N O | P b c a | 8.4285; 19.2055; 19.7809 90; 90; 90 | 3202 | Kailani, Mohammed H.; Awwadi, Firas F. 4-(9H-Fluoren-9-yl)-4-methylmorpholin-4-ium bromide, C18H20BrNO Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 179-180 |
| 8104919 | CIF | C14 H15 Cl N4 O5 S2 | P b c a | 16.1956; 11.7856; 18.7814 90; 90; 90 | 3584.9 | Miao, Ming-zhi; Li, Ji The crystal structure of 4-hydroxy-2,5-bis(1-methyl-1H-imidazol-3-ium-2-ylthio)-3,6-dioxocyclohexa-1,4-dienolate chloride monohydrate, C14H15N4O5S2Cl Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 189-191 |
| 8104945 | CIF | C9 H10 O3 | P b c a | 14.257; 7.925; 29.8796 90; 90; 90 | 3376 | Hosten, Eric C.; Betz, Richard The crystal structure of 2-(2-methoxyphenyl)acetic acid, C9H10O3 Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 277-279 |
| 8104953 | CIF | C12 H12 I4 Os2 | P b c a | 11.972; 10.4991; 13.281 90; 90; 90 | 1669.36 | Tapala, Kgaugelo C.; Clayton, Hadley S. The crystal structure of bis(μ2-iodido)-bis(η6-benzene)-bis(iodido)-diosmium(II), C12H12I4Os2 Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 31-32 |
| 8105024 | CIF | C8 H6 Cl I O2 | P b c a | 13.3204; 7.2517; 18.5627 90; 90; 90 | 1793.07 | Mphahlele, Malose J. Crystal structure of 1-(4-chloro-2-hydroxy-5-iodophenyl)ethan-1-one, C8H6ClIO2 Zeitschrift für Kristallographie - New Crystal Structures, 2019, 235, 81-83 |
| 8105055 | CIF | C24 H44 Cl2 N2 O4 Sn4 | P b c a | 13.9593; 11.1227; 21.6656 90; 90; 90 | 3363.91 | Lo, Kong Mun; Lee, See Mun; Tiekink, Edward R.T. Crystal structure of dichlorido-octamethyl-bis(μ3-oxido)-bis(μ2-2-(phenylamino)ethanolato-κ2O:O)tetratin(IV), C24H44Cl2N2O4Sn4 Zeitschrift für Kristallographie - New Crystal Structures, 2019, 235, 193-195 |
| 8105058 | CIF | C19 H20 Mo N2 O6 S | P b c a | 13.406; 16.5112; 17.6357 90; 90; 90 | 3903.65 | Lo, Kong Mun; Lee, See Mun; Tiekink, Edward R.T. Crystal structure of (dimethyl sulfoxide)-dioxido-[2-hydroxy-N′-(4-oxo-4-phenylbutan-2-ylidene)benzohydrazidato κ3N,O,O′]molybdenum(VI), C19H20MoN2O6S Zeitschrift für Kristallographie - New Crystal Structures, 2019, 235, 203-205 |
| 8105101 | CIF | C16 H22 Cd N4 O4 P2 S4 | P b c a | 12.6641; 13.0014; 15.3072 90; 90; 90 | 2520.35 | Tan, Yee Seng; Tiekink, Edward R.T. Crystal structure of catena-poly[(μ2-1,2-bis(3-pyridylmethylene)hydrazine-κ2 N:N′)-bis(O,O′-dimethyl dithiophosphato-κ2-S,S′)cadmium(II)], {C16H22CdN4O4P2S4}n Zeitschrift für Kristallographie - New Crystal Structures, 2020, 235, 339-341 |
| 8105103 | CIF | C12 H15 N3 O S2 Sn | P b c a | 13.101; 11.151; 20.855 90; 90; 90 | 3047 | Sun, Junshan The crystal structure of catena-poly[(E)-2-(((5-((trimethylstannyl)thio)-1,3,4-thiadiazol-2-yl)imino)methyl)phenol], C12H15N3OS2Sn Zeitschrift für Kristallographie - New Crystal Structures, 2020, 235, 347-348 |
| 8105104 | CIF | C36 H39 Cl2 N O P2 Pd | P b c a | 19.209; 15.144; 24.011 90; 90; 90 | 6985 | Kama, Dumisani V.; Brink, Alice; Roodt, Andreas Crystal structure of dichlorido(N-o-tolyl-1,1-di-p-tolylphosphanamine–κ1 P)-(methoxydi-p-tolylphosphane-κ1 P)palladium(II), C36H39Cl2NOP2Pd Zeitschrift für Kristallographie - New Crystal Structures, 2020, 235, 349-352 |
| 8105108 | CIF | C19 H19 Cl2 N O5 | P b c a | 12.675; 11.0927; 28.4 90; 90; 90 | 3993 | Guo, You-Yuan; Wang, Huan; Ma, Xin; Fu, Ying Crystal structure of 5,5-dimethyl-3-oxocyclohex-1-en-1-yl 4-(2,2-dichloroacetyl)-3,4-dihydro-2 H-benzo[b][1,4]oxazine-7-carboxylate, C19H19Cl2NO5 Zeitschrift für Kristallographie - New Crystal Structures, 2020, 235, 361-363 |
| 8105122 | CIF | C19 H17 F N4 O | P b c a | 7.0607; 18.4459; 23.8955 90; 90; 90 | 3112.17 | Chen, Yu Hang; Dan, Yan Rong; Gan, Lin Ling; Yu, Yu Crystal structure of 3-fluoro-9-methoxy-4b,5,14,15-tetrahydro-6H-isoquinolino [2′,1′:1,6]pyrazino[2,3-b]quinoxaline, C19H17FN4O Zeitschrift für Kristallographie - New Crystal Structures, 2020, 235, 401-402 |
| 8105176 | CIF | C15 H11 N5 S | P b c a | 9.7864; 15.5709; 18.7774 90; 90; 90 | 2861.36 | Sun, Guo-Xiang; Min, Li-Jing; Han, Liang; Liu, Xing-Hai Crystal structure of 2-((4-phenyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl)thio)acetonitrile, C15H11N5S Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 199-200 |
| 8105182 | CIF | C5 H6 Br N5 O4 | P b c a | 11.437; 6.9921; 22.8443 90; 90; 90 | 1826.83 | Jiaxiang, Zhao; Pengbao, Lian; Jun, Chen; Chong, Li; Jianlong, Wang The crystal structure of 1-(2-bromoethane)-4-amine-3,5-dinitropyrazole, C5H6Br1N5O4 Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 215-216 |
| 8105195 | CIF | C13 H16 N6 | P b c a | 16.097; 9.8309; 17.349 90; 90; 90 | 2745.4 | Wu, Gui-Ling The crystal structure of tris(4-methyl-1H-pyrazol-1-yl)methane, C13H16N6 Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 253-254 |
| 8105227 | CIF | C40 H36 Cl2 N2 O2 | P b c a | 10.6137; 20.1559; 31.4991 90; 90; 90 | 6738.6 | Wang, Xiaoxia; Zhang, Danyang; Zhuang, Pengyu; Zhang, Yao; Xu, Jiale Crystal structure of 3,10-bis(4-chlorophenyl)-6,12-dibenzyl-2,9-acetyl-6,12-diazapentacyclo[6.3.1.02,7.04,11.05,9]-dodecane, C40H36Cl2N2O2 Zeitschrift für Kristallographie - New Crystal Structures, 2020, 235, 587-588 |
| 8105232 | CIF | C17 H16 N6 O7 Zn | P b c a | 16.8032; 13.278; 17.9636 90; 90; 90 | 4007.9 | Tao, Defu; Pang, Haixia; Hu, Chuanqun; Tang, Qiang Crystal structure of catena-poly[(μ2-1,5-dimethyl-2-phenyl-4-((pyridin-4-ylmethylene)amino)-1,2-dihydro-3H-pyrazol-3-one-κ2 N:O)-bis(nitrato-κ1 O)zinc(II)], C17H16N6O7Zn Zeitschrift für Kristallographie - New Crystal Structures, 2020, 235, 601-603 |
| 8105325 | CIF | C17 H16 Br2 Fe N5 O3 | P b c a | 11.9307; 14.8166; 22.923 90; 90; 90 | 4052.2 | Xiao, Jianchang; Zhou, Cun; Huang, Meifen; Tan, Hui; Wu, Qiong Crystal structure of aqua-azido-κ1 N-(6,6′-((propane-1,3-diylbis(azanylylidene))bis(methanylylidene))bis(3-bromophenolato)-κ4 N,N′,O,O′iron(III), C17H16Br2FeN5O3 Zeitschrift für Kristallographie - New Crystal Structures, 2020, 235, 903-904 |
| 8105355 | CIF | C19 H21 N O2 S | P b c a | 16.792; 9.153; 22.809 90; 90; 90 | 3505.7 | Liu, Huixia; Huang, Xie; He, Wei Crystal structure of 5-methyl-3-phenyl-1-tosyl-1,2,3,4-tetrahydropyridine, C19H21NO2S Zeitschrift für Kristallographie - New Crystal Structures, 2020, 235, 993-994 |
| 8105356 | CIF | C16 H12 Cl2 N2 Ni O2 | P b c a | 12.5166; 12.5881; 19.0086 90; 90; 90 | 2995 | Xiao, Jianchang; Zhou, Cun; Tan, Hui; Huang, Meifen; Wu, Qiong Crystal structure of bis((3-chlorosalicylidene)-ethylenediaminato-κ4N,N′,O,O′)nickel (II), C16H12Cl2NiN2O2 Zeitschrift für Kristallographie - New Crystal Structures, 2020, 235, 995-996 |
| 8105363 | CIF | C18 H19 N2 O8 Zn | P b c a | 17.4714; 10.918; 20.0697 90; 90; 90 | 3828.4 | Li, Guoqiang; Chen, Guo; Liu, Yanping; Wang, Gao; Liu, Liyu Poly[bis(dimethylformamide-κO)-(μ8-5,5′′-dicarboxy-[1,1′:4′,1′′-terphenyl]-2′,3,3′′,5′-tetracarboxylato-κ8 O:O 1:O 2:O 3:O 4:O 5:O 6:O 7)dizinc(II)] — dimethylformamide (1/2), C18H19N2O8Zn Zeitschrift für Kristallographie - New Crystal Structures, 2020, 235, 1011-1013 |
| 8105432 | CIF | C20 H18 Cl4 O S Sn | P b c a | 12.7348; 14.6361; 24.158 90; 90; 90 | 4502.76 | Lee, See Mun; Lo, Kong Mun; Tiekink, Edward R.T. Crystal structure of chloridotris(4-chlorophenyl)(dimethyl sulfoxide-κO)tin(IV), C20H18Cl4OSSn Zeitschrift für Kristallographie - New Crystal Structures, 2020, 235, 1241-1243 |
| 8105474 | CIF | C16 H12 O3 | P b c a | 10.7095; 8.1455; 27.5374 90; 90; 90 | 2402.2 | Olomola, Temitope O.; Maluleka, Marole M.; Mphahlele, Malose J. Crystal structure of 1-(6-hydroxy-2-phenylbenzofuran-5-yl)ethan-1-one, C16H12O3 Zeitschrift für Kristallographie - New Crystal Structures, 2020, 235, 1389-1391 |
| 8105484 | CIF | C23 H28 N2 O2 | P b c a | 10.713; 15.689; 24.485 90; 90; 90 | 4115.3 | Guerrab, Walid; Mague, Joel T.; Ramli, Youssef Synthesis and crystal structure of 3-octyl-5,5-diphenylimidazolidine-2,4-dione, C23H28N2O2 Zeitschrift für Kristallographie - New Crystal Structures, 2020, 235, 1425-1427 |
| 8105488 | CIF | C12 H15 N3 S | P b c a | 11.9612; 8.1215; 27.5865 90; 90; 90 | 2679.83 | Tan, Ming Yueh; Ho, Sheng Zhou; Tan, Kong Wai; Tiekink, Edward R.T. Crystal structure of 3-ethyl-1-[(E)-[(2E)-3-phenylprop-2-en-1-ylidene]amino]thiourea, C12H15N3S Zeitschrift für Kristallographie - New Crystal Structures, 2020, 235, 1439-1441 |
| 8105512 | CIF | C44 H48 Cl2 O2 P2 Sn | P b c a | 17.8312; 12.0291; 18.5895 90; 90; 90 | 3987.32 | Lee, See Mun; Lo, Kong Mun; Tiekink, Edward R.T. Crystal structure of dichloridodimethylbis(tri-4-tolylphosphane oxide-κO)-tin(IV), C44H48Cl2O2P2Sn Zeitschrift für Kristallographie - New Crystal Structures, 2020, 235, 1527-1529 |
| 8105521 | CIF | C16 H12 Cl2 Cu N2 O2 | P b c a | 12.8449; 12.5266; 19.054 90; 90; 90 | 3065.8 | Ju, Hongping; Li, Meihua; Chen, Zihao; Wu, Qiong; Chai, Yanling Crystal structure of (6,6′-((ethane-1,2-diylbis(azanylylidene))bis(methanylylidene))bis(2-chlorophenolato-κ2 N,O))copper(II), C16H12Cl2CuN2O2 Zeitschrift für Kristallographie - New Crystal Structures, 2018, 234, 3-4 |
| 8105631 | CIF | C30 H23 N O2 | P b c a | 10.7674; 19.542; 20.97 90; 90; 90 | 4412.4 | Zuo, Zhenyu; Hu, Kunxia; Song, Xiao; Zhang, Hong; Tang, Zhishu The crystal structure of 1,5-di(naphthalen-2-yl)-3-(pyridin-2-yl)pentane-1,5-dione, C30H23NO2 Zeitschrift für Kristallographie - New Crystal Structures, 2019, 234, 325-326 |
| 8105641 | CIF | C12 H14 F N3 S2 Sn | P b c a | 12.954; 11.494; 20.825 90; 90; 90 | 3100.7 | Sun, Junshan Crystal structure of catena-poly[(1-(4-fluorophenyl)-N–(5-((trimethylstannyl)thio)-1,3,4-thiadiazol-2-yl)methanimine], (C12H14FN3S2Sn)n Zeitschrift für Kristallographie - New Crystal Structures, 2019, 234, 347-348 |
| 8105659 | CIF | C50 H44 Cl4 Co F2 N2 P2 | P b c a | 18.4662; 15.2888; 33.2661 90; 90; 90 | 9391.9 | Kanchanadevi, S.; Fronczek, Frank R.; Arun, V.; Mahalingam, V. Crystal structure of bis[(((4-fluorophenyl)amino)methyl)triphenylphosphonium] tetrachloridocobaltate(II), C50H44Cl4CoF2N2P2 Zeitschrift für Kristallographie - New Crystal Structures, 2019, 234, 401-403 |
| 8105668 | CIF | C46 H44 Cl6 F12 N4 P4 Ru | P b c a | 14.319; 16.7358; 22.6972 90; 90; 90 | 5439.2 | Junwei, Zheng; Lu, Xiu Lian Crystal structure of trans-tetrakis(acetonitrile-κN)bis(triphenylphosphine-κP)ruthenium(II) dihexafluorophosphate - dichloroform (1/2), C46H44Cl6F12N4P4Ru Zeitschrift für Kristallographie - New Crystal Structures, 2019, 234, 425-427 |
| 8105670 | CIF | C36 H44 Cl2 N4 O12 Zn3 | P b c a | 8.3378; 21.188; 22.802 90; 90; 90 | 4028.2 | Tan, Yuye; Huang, Junjie; Lu, Hui; Sun, Jianhua Crystal structure of diaqua-dichlorido-bis(μ3-6,6′-(hydrazine-1,2-diylidenebis(methanylylidene))bis(2-methoxyphenolato)κ6 O,N:N′,O′,O′:O′′)trizinc(II) - ethanol (1/2), C36H44Cl2N4O12Zn3 Zeitschrift für Kristallographie - New Crystal Structures, 2019, 234, 431-432 |
| 8105680 | CIF | C25 H31 Cl2 N3 O Pd | P b c a | 9.4083; 17.1334; 31.9251 90; 90; 90 | 5146.2 | Sun, Kai-Xin; Wu, Xiang-Ting; Li, Guo-Xing Crystal structure of trans-dichlorido-(1,3-dimesityl-1H-imidazol-2(3H)-ylidene)-(5-methyl-3,4-dihydro-2H-pyrrole-κN)palladium(II), C25H31Cl2N3OPd Zeitschrift für Kristallographie - New Crystal Structures, 2019, 234, 455-456 |
| 8105702 | CIF | C19 H27 B2 F8 N5 | P b c a | 9.8515; 16.508; 29.817 90; 90; 90 | 4849.1 | Ywaya, David O.; Friedrich, Holger B.; Bala, Muhammad D.; Soobramoney, Lynette; Ibrahim, Halliru Crystal structure of 3,3′-(pyridine-2,6-diylbis(methylene))bis(1-propyl-1H-imidazol-3-ium) ditetrafluoroborate, C19H27B2F8N5 Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 381-383 |
| 8105802 | CIF | C20 H30 Cl6 Co N2 | P b c a | 20.7559; 9.3427; 27.6827 90; 90; 90 | 5368.1 | Ayom, Gwaza E.; Zamisa, Sizwe J.; Van Zyl, Werner E. Crystal structure of 1,1′-methylenebis(4-tert-butylpyridinium) tetrachloridocobaltate(II) – dichloromethane (1:1), C20H30Cl6CoN2 Zeitschrift für Kristallographie - New Crystal Structures, 2019, 234, 629-631 |
| 8105808 | CIF | C14 H24 Cl2 N4 Zn | P b c a | 13.3238; 15.9366; 18.0943 90; 90; 90 | 3842.1 | Li, Zongmu The crystal structure of dichlorido-bis(1-butyl-1H-imidazole-κN)zinc(II), C14H24Cl2ZnN4 Zeitschrift für Kristallographie - New Crystal Structures, 2019, 234, 649-651 |
| 8105818 | CIF | C6 H N9 O6 | P b c a | 10.5199; 13.436; 15.235 90; 90; 90 | 2153.4 | Peilan, Wang; Jianlong, Wang; Lizhen, Chen The crystal structure of 1,3,5-trinitro-4,6-diazidobenzene, C6HN9O6 Zeitschrift für Kristallographie - New Crystal Structures, 2019, 234, 681-682 |
| 8105831 | CIF | C19 H16 N2 O2 | P b c a | 12.2; 9.58; 25.06 90; 90; 90 | 2928.9 | Xi-Shi, Tai; Li-Hua, Wang; Li-Li, Liu; Xiao-Jing, Zhou The crystal structure of (E)-N′-((2-hydroxynaphthalen-1-yl)methylene)-2-phenylacetohydrazide, C19H16O2N2 Zeitschrift für Kristallographie - New Crystal Structures, 2019, 234, 723-724 |
| 8105865 | CIF | C46 H98 B2 N2 O17 | P b c a | 16.485; 17.441; 41.1 90; 90; 90 | 11817 | Cui, Yongxia; Chen, Xiaohui; Zhang, Tingting Crystal structure of tetrabutylammonium 4,4-oxydibenzoate – boric acid – water (1/2/6) C46H98B2N2O17 Zeitschrift für Kristallographie - New Crystal Structures, 2019, 234, 831-834 |
| 8105914 | CIF | C14 H14 Cl N3 S | P b c a | 10.4; 11.5622; 23.4776 90; 90; 90 | 2823.11 | Yeo, Chien Ing; Tiekink, Edward R.T. Crystal structure of 1-(4-chlorophenyl)-3-[methyl(phenyl)amino]thiourea, C14H14ClN3S Zeitschrift für Kristallographie - New Crystal Structures, 2019, 234, 989-990 |
| 8105915 | CIF | C10 H13 N3 | P b c a | 9.4795; 10.7585; 18.8783 90; 90; 90 | 1925.3 | Huang, Guo-Ling; Chen, Xiu-Wen; Chen, Lu; Li, Yi-Biao Crystal structure of 2-tert-butyl-1H-imidazo[4,5-b]pyridine, C10H13N3 Zeitschrift für Kristallographie - New Crystal Structures, 2019, 234, 991-992 |
| 8105924 | CIF | C29 H50 Cl2 N4 Ni O8 | P b c a | 20.601; 13.5059; 25.015 90; 90; 90 | 6960 | Guang-Chuan, Ou; Jia, Guo-Kai; Tan, Ying-Zhi Crystal structure of [(2-(2-chlorophenyl)-5-ethyl-1,3-dioxane-5-carboxylato-κ2 O,O′) (5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane-κ4 N,N′,N′′,N′′′)]nickel(II) perchlorate, C29H50Cl2N4NiO8 Zeitschrift für Kristallographie - New Crystal Structures, 2019, 234, 1019-1021 |
| 8105930 | CIF | C20 H15 N3 | P b c a | 11.0487; 13.5; 21.1032 90; 90; 90 | 3147.7 | Lou, Xin-Hua Crystal structure of 2-(2-(6-methylpyridin-2-yl)naphthalen-1-yl)pyrimidine, C20H15N3 Zeitschrift für Kristallographie - New Crystal Structures, 2019, 234, 1037-1038 |
| 8105934 | CIF | C47 H43 Fe2 N5 O10 | P b c a | 24.6961; 14.0952; 24.696 90; 90; 90 | 8596.6 | Ya, Li; Xiangqing, Fang; Junyi, Liu; Chi, Dong; Liguo, Yang Crystal structure of (μ2-oxido)-bis(N,N′-o-phenylenebis(salicylideneiminato))diiron(III) — N,N′-dimethylformamide, C47H43Fe2N4O9 Zeitschrift für Kristallographie - New Crystal Structures, 2019, 234, 1051-1053 |
| 8105965 | CIF | C24 H23 F N2 O4 S | P b c a | 14.3646; 15.5927; 19.645 90; 90; 90 | 4400.1 | Cai, Zedong; Huang, Xie; He, Wei Crystal structure of 3-fluoro-3-methyl-1-((2-nitrophenyl)sulfonyl)-5,5-diphenylpiperidine, C24H23FN2O4S Zeitschrift für Kristallographie - New Crystal Structures, 2019, 234, 1161-1162 |
| 8105988 | CIF | C15 H17 N O4 S | P b c a | 9.989; 14.4529; 21.635 90; 90; 90 | 3123.4 | Wu, Deng-Ze The crystal structure of ethyl 2-(3-(2-ethoxy-2-oxoethyl)benzo[d] thiazol-2(3H)-ylidene)acetate, C15H17NO4S Zeitschrift für Kristallographie - New Crystal Structures, 2019, 234, 1225-1226 |
| 8105993 | CIF | C22 H45 K0.26 N2 O6 Rb0.74 | P b c a | 10.1587; 16.2842; 32.862 90; 90; 90 | 5436.2 | Henneberger, Thomas; Klein, Wilhelm; Fässler, Thomas F. Crystal structure of (1,4,7,10,13,16-hexaoxacyclooctadecane-κ6O6) 1,2,3,4,5-pentamethyl-cyclopenta-2,4-dien-1-yl(potassium, rubidium) — ammonia (1/2), [K0.3Rb0.7(18-crown-6)]Cp*⋅2 NH3, C22H45K0.3N2O6Rb0.7 Zeitschrift für Kristallographie - New Crystal Structures, 2019, 234, 1241-1243 |
| 8106025 | CIF | C16 H15 Cl N2 O3 | P b c a | 18.7178; 15.2296; 32.0558 90; 90; 90 | 9137.97 | Lee, See Mun; Lo, Kong Mun; Tiekink, Edward R.T. Crystal structure of 4-chloro-N′-[(1E)-(3-ethoxy-2-hydroxyphenyl)methylidene]benzohydrazide – a Z′ = 3 structure, C16H15ClN2O3 Zeitschrift für Kristallographie - New Crystal Structures, 2019, 234, 1341-1344 |
| 8106138 | CIF | C9 H11 Cl N4 O2 | P b c a | 8.9735; 12.2946; 19.3751 90; 90; 90 | 2137.6 | Ali, Syed Saeed; Al-Obaid, Abdulrahman M.; Hosten, Eric C.; Bari, Ahmed The crystal structure of 8-chloro-7-ethyl-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione, C9H11ClN4O2 Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 317-318 |
| 8106144 | CIF | C28 H23 F N2 O3 Sn | P b c a | 16.0887; 14.5333; 20.555 90; 90; 90 | 4806.21 | Tan, Yee Seng; Lee, See Mun; Tiekink, Edward R.T. Crystal structure of (N-(3-ethoxy-2-oxidobenzylidene)-4-fluorobenzohydrazonato-κ3 N,O,O′)-diphenyltin(IV), C28H23FN2O3Sn Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 331-333 |
| 8106183 | CIF | C42 H48 Fe Ni2 O P2 | P b c a | 9.4551; 19.7133; 39.693 90; 90; 90 | 7398.4 | Langen, Christina; Bruhn, Clemens; Siemeling, Ulrich Synthesis and crystal structure of μ-[1,1′-di(mesitylphosphanido)ferrocene]bis[η5-cyclopentadienylnickel(II)] tetrahydrofurane solvate, C42H48FeNi2OP2 Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 459-461 |
| 8106267 | CIF | C21 H17 N3 O3 | P b c a | 14.3606; 7.425; 34.284 90; 90; 90 | 3655.62 | Xiao, Xin-Sheng; Jia, Guo-Kai; Li, Wen-Yi; Chen, Xiu-Wen Crystal structure of (Z)-N-(4-nitrophenyl)-3-phenyl-3-(phenylamino)acrylamide, C21H17N3O3 Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 699-700 |
| 8106302 | CIF | C21 H22 N2 O3 | P b c a | 15.093; 13.896; 17.501 90; 90; 90 | 3670.5 | Meng, Qing-Hua; Long, Xu; Liu, Jing-Li; Zhang, Shuan; Zhang, Guang-Hui Crystal structure of methyl 4-(3-cyanophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-quinoline-3-carboxylate, C21H22N2O3 Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 805-806 |
| 8106310 | CIF | C22 H24 N2 O3 | P b c a | 15.333; 14.146; 17.64 90; 90; 90 | 3826 | Song, Ji-Dong; Wang, Li-Li Crystal structure of ethyl 4-(3-cyanophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, C22H24N2O3 Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 823-824 |
| 8106329 | CIF | C29 H24 Bi2 O5 | P b c a | 14.8835; 14.5551; 23.6 90; 90; 90 | 5112.5 | Tan, Nianyuan; Dang, Limin; Lan, Donghui; Wu, Shuisheng; Au, Chak-Tong; Yi, Bing Crystal structure of bis{5H-dibenzo[c,f][1,5]oxabismocin-12(7H)-yl} carbonate, C29H24O5Bi2 Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 875-877 |
| 8106352 | CIF | C17 H13 Br N2 | P b c a | 9.995; 13.845; 20.213 90; 90; 90 | 2797.1 | Zhang, Min; Li, Zhong-Yan; Yuan, Xian-You; Yuan, Lin Crystal structure of 2-(4-bromophenyl)-2,3-dihydro-1H-perimidine, C17H13BrN2 Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 935-936 |
| 8106371 | CIF | C24 H21 N3 O5 | P b c a | 8.4167; 14.037; 34.664 90; 90; 90 | 4095.4 | Sun, Yutong; Hong, Wei; Wang, Hao Crystal structure of methyl 2-((1-(2-(methoxycarbonyl)benzyl)-1H-1,2,3-triazol-4-yl)methoxy)-1-naphthoate, C24H21N3O5 Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 985-986 |
| 8106403 | CIF | C12 H18 O2 | P b c a | 17.956; 9.8553; 25.5955 90; 90; 90 | 4529.4 | Wang, Limin; Zhao, Linxiu; Qin, Tingting Crystal stucture of 2-(tert-butyl)-6-(hydroxymethyl)-4-methylphenol, C12H18O2 Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 1071-1072 |
| 8106459 | CIF | C10 H9 Cl2 N2 O4 | P b c a | 11.151; 7.0923; 29.243 90; 90; 90 | 2312.7 | Qi, Bo-Shu; Sun, Xiao-Nan; Yang, Huan-Huan; Fu, Ying; Ye, Fei Crystal structure of 2-dichloromethyl-2-p-nitrophenyl-1,3-dioxolane, C10H9Cl2NO4 Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 137-138 |
| 8106486 | CIF | C4 H3 I N4 O4 | P b c a | 9.9513; 11.3365; 14.3295 90; 90; 90 | 1616.55 | Lizhen, Chen; Pengbao, Lian; Jianlong, Wang The crystal structure of 1-methyl-2,4-dinitro-5-iodoimidazole, C4H3IN4O4 Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 213-214 |
| 8106532 | CIF | C29 H30 Co N4 O5 | P b c a | 11.6532; 20.1493; 22.609 90; 90; 90 | 5308.7 | Han, Min-Le; Wang, San-Tai; Zhou, Zhe Crystal structure of poly-[(μ2-((1,3-bis(benzimidazol-1-yl)propane-κ2 N:N′)(μ2-4-tert-butyl-phthalato-κ2 O:O′)cobalt(II)] monohydrate, C29H30CoN4O5 Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 347-349 |
| 8106559 | CIF | C19 H16 F I N2 | P b c a | 15.1714; 14.061; 15.9365 90; 90; 90 | 3399.65 | Li, Zhong-Yan; Zhang, Min; Yuan, Xian-You; Yuan, Lin Crystal structure of 2-(4-fluorophenyl)-1,3-dimethyl-1H-perimidin-3-ium iodide, C19H16FIN2 Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 429-430 |
| 8106603 | CIF | C22 H18 N2 O3 | P b c a | 14.8532; 11.3579; 22.1712 90; 90; 90 | 3740.3 | Zhang, Chang-Hu Crystal structure of 2-amino-4-(4-isopropyl-phenyl)-3-cyano-5-oxo-4H,5H-pyrano[3,2-c]chromene, C22H18N2O3 Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 565-566 |
| 8106605 | CIF | C20 H12 Br2 N4 O7 Zn | P b c a | 22.593; 7.22; 26.225 90; 90; 90 | 4278 | Hong, Yong; Xu, Shijuan; Liu, Wei Crystal structure of monoaqua-[6,6′-((1E,1′E)-(1,2-phenylene bis(azanylylidene))bis(methanylylidene))bis(4-bromo-2-nitrophenolato-κ4 N,N′,O,O′)]zinc(II), C20H12Br2N4O7Zn Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 571-572 |
| 8106723 | CIF | C7 H17 Cl2 N2 Na O9 | P b c a | 13.907; 10.927; 19.194 90; 90; 90 | 2916.8 | Liu, Mei-Ying Crystal structure of 1-methyl-1,4-diazabicyclo[2.2.2]octan-1-ium poly[aqua-bis(μ2-perchlorato-κ3 O,O′:O′′)sodium], C7H17Cl2N2NaO9 Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 927-928 |
| 8106725 | CIF | C21.5 H64 N19 O10.5 | P b c a | 19.556; 20.105; 20.573 90; 90; 90 | 8089 | Zhu, Xin; Liu, Xianghua Crystal structure of dodecaguanidinium bis(tetrapropylammonium) heptacarbonate, C43H128N38O21 Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 931-933 |
| 8106745 | CIF | C20 H20 N2 O3 | P b c a | 9.13; 16.17; 24 90; 90; 90 | 3543.2 | Wei, Ya-Nan; Li, Chuan-Bi; Li, Xue; Sun, Han-Yang Crystal structure of 1,3-dimethyl-5,5-dibenzylbarbituric acid, C20H20N2O3 Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 993-994 |
| 8106748 | CIF | C8 H8 Br N O2 | P b c a | 10.1313; 8.5416; 20.4597 90; 90; 90 | 1770.53 | Karczmarzyk, Zbigniew; Pitucha, Monika; Wysocki, Waldemar; Morawiak, Maja; Sobótka-Polska, Karolina; Urbańczyk-Lipkowska, Zofia The crystal structure of methyl N-(4-bromophenyl)carbamate, C8H8BrNO2 Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 1003-1004 |
| 8106758 | CIF | C20 H21 N3 | P b c a | 12.2422; 7.1996; 39.037 90; 90; 90 | 3440.7 | Zhang, Zhi-Mao; Chen, Lian-Hui The crystal structure of N,N-dimethyl-2,6-di-p-tolylpyrimidin-4-amine, C20H21N3 Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 1029-1030 |
| 8106783 | CIF | C27 H25 N4 O9 Zn | P b c a | 14.5349; 17.3183; 20.8872 90; 90; 90 | 5257.7 | Xiao-Ling, Li; Ke-Qiang, Wang; Zhao-Xiao, Li; Xue, Zhang Crystal structure of diaqua(μ2-1,1′-biphenyl-4,4′-diylbis(1H-imidazole)-κ2 N:N′)tetrakis(3-carboxy-5-ethylpyridine-2-carboxylato-κ2 N,O)dizinc(II), C54H50N8O18Zn2 Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 53-55 |
| 8106918 | CIF | C6 H6.66 N12 O12.33 | P b c a | 9.5358; 13.2415; 23.621 90; 90; 90 | 2982.6 | Yu, Yuehai; Jin, Shaohua; Zhu, Jiaping; Li, Lijie; Chen, Shusen; Shu, Qinghai Crystal structure of 2,4,6,8,10,12-hexanitro-2,4,6,8,10,12-hexaazatetracyclo[5·5·0·05·9·03·11]dodecane 1/3 hydrate, C6H8N12O13 Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 491-492 |
| 8106930 | CIF | C19.88 H27.64 Cl1.12 N2 P Si | P b c a | 16.811; 14.357; 17.523 90; 90; 90 | 4229.3 | Breuers, Verena; Frank, Walter The crystal structure of 2-chloro-1,3-bis(2,4,6-trimethylphenyl)-4,4-dimethyl-1,3,2λ3,4-diazaphosphasiletidine Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 529-532 |
| 8106949 | CIF | C17 H22 N2 S | P b c a | 12.0579; 11.1213; 21.9741 90; 90; 90 | 2946.7 | Al-Wahaibi, Lamya H.; Ghabbour, Hazem A.; Mostafa, Gamal A. E.; Almutairi, Maha S.; El-Emam, Ali A. Crystal structure of 1-(adamantan-1-yl)-3-phenylthiourea, C17H22N2S Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 593-595 |
| 8106966 | CIF | C13 H12 N4 O2 | P b c a | 16.2353; 16.8474; 36.028 90; 90; 90 | 9854.5 | Pansuriya, Pramod B.; Patel, Chintan; Friedrich, Holger B.; Maguire, Glenn E. M. Crystal structure of N-phenyl-2-(pyridin-4-ylcarbonyl)hydrazinecarboxamide with Z′ = 4, C13H12N4O2 Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 649-652 |
| 8106983 | CIF | C17 H21 Cl N2 S | P b c a | 17.2134; 8.2251; 22.522 90; 90; 90 | 3188.71 | Al-Omary, Fatmah A. M.; Ghabbour, Hazem A.; AlRabiah, Haitham; Al-Abdullah, Ebtehal S.; El-Emam, Ali A. Crystal structure of 1-(adamantan-1-yl)-3-(4-chlorophenyl)thiourea, C17H21ClN2S Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 707-709 |
| 8106986 | CIF | C14 H11 N O2 | P b c a | 10.3868; 7.7695; 26.576 90; 90; 90 | 2144.7 | Xiao, Zheng-Kang; Lu, Jian-Mei Crystal structure of 3-hydroxy-3-phenyl-1,3-dihydro-2H-indol-2-one, C14H11NO2 Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 719-720 |
| 8107032 | CIF | C11 H14 N2 O3 S | P b c a | 10.1973; 9.9487; 23.1332 90; 90; 90 | 2346.86 | Ghorab, Mostafa M.; Alsaid, Mansour S.; Ghabbour, Hazem A.; Al-Mishari, Abdullah A. Crystal structure of (Z)-4-(4-oxopent-2-en-2-ylamino)benzenesulfonamide, C11H14N2O3S Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 867-869 |
| 8107074 | CIF | C21 H29 N3 S | P b c a | 9.8658; 11.7298; 31.96 90; 90; 90 | 3698.5 | Al-Abdullah, Ebtehal S.; Ghabbour, Hazem A.; Alkahtani, Hamad M.; Al-Tamimi, Abdul-Malek S.; El-Emam, Ali A. Crystal structure of N-(adamantan-1-yl)-4-phenylpiperazine-1-carbothioamide, C21H29N3S Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 991-993 |
| 8107086 | CIF | C17 H21 Br N2 S | P b c a | 17.0675; 8.3422; 22.597 90; 90; 90 | 3217.4 | Al-Omary, Fatmah A. M.; Al-Rasheed, Lamees S.; Ghabbour, Hazem A.; El-Emam, Ali A. Crystal structure of 1-(adamantan-1-yl)-3-(4-bromophenyl)thiourea, C17H21BrN2S Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 1033-1035 |
| 8107087 | CIF | C18 H20 Cl2 N2 O | P b c a | 8.1023; 18.7063; 22.5509 90; 90; 90 | 3417.91 | Aljohar, Haya I.; Ghabbour, Hazem A.; Abdelbaky, Mohammed S.M.; Garcia-Granda, Santiago; El-Emam, Ali A. Crystal structure of N′-[(1E)-(2,6-dichlorophenyl)-methylidene]adamantane-1-carbohydrazide, C18H20Cl2N2O Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 1037-1039 |
| 8107091 | CIF | C11 H13 Cr N2 O9 | P b c a | 6.774; 12.309; 32.776 90; 90; 90 | 2732.9 | Xie, Ling; Feng, Sisi; Lu, Liping; Zhu, Miaoli The crystal structure of diaqua-(N-(2-hydroxy-5-nitrobenzyl)iminodiacetato-κ4-N,O,O′,O′′)chromium(III) based on synchrotron data, C11H13CrN2O9 Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 1047-1049 |
| 8107094 | CIF | C22 H28 Br2 O4 Os2 | P b c a | 10.8433; 11.8395; 18.7871 90; 90; 90 | 2411.87 | Clayton, Hadley S.; Tapala, Kgaugelo C.; Lemmerer, Andreas Crystal structure of dibromido μ-oxalato-κ2 O,O′:κ2 O′′,O′′′−η6-p-cymenediosmium(II), C22H28Br2O4Os2 Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 1055-1056 |
| 8107098 | CIF | C11 H16 N2 O | P b c a | 10.7388; 9.8449; 21.1259 90; 90; 90 | 2233.5 | El-Hiti, Gamal A.; Smith, Keith; Alshammari, Mohammed B.; Alotaibi, Mohammad Hayal; Kariuki, Benson M. Crystal structure of 1,1-dimethyl-3-(2-phenylethyl)urea, C11H16N2O Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 1065-1066 |
| 8107147 | CIF | C13 H15 Br O4 | P b c a | 15.894; 7.6064; 21.571 90; 90; 90 | 2607.9 | Yuan, Lin; Yuan, Xian-You; Li, Zhong-Yan; Zhang, Min Crystal structure of 2-(2-bromophenyl)-5-ethyl-1,3-dioxane-5-carboxylic acid, C13H15BrO4 Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 1209-1210 |
| 8107151 | CIF | H2 K Li Mo O5 | P b c a | 10.606; 7.742; 12.845 90; 90; 90 | 1054.7 | Park, Garam; Oh, In-Hwan; Kyeong Yu, Su; Park, Hyun-Min; Kim, Ho-Sung Redetermination of the crystal structure of potassium lithium molybdate monohydrate, KLiMoO4·H2O Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 1221-1222 |
| 8107178 | CIF | C18 H16 Cl4 N2 O3 V | P b c a | 7.8555; 21.6645; 23.7584 90; 90; 90 | 4043.3 | Wei, Wei; Zhang, Ya-Zhai; Zhang, Heng-Qiang; Zhang, Qi-Ying; Xuan, Zhao-Kun; Chen, Hong-Li The crystal structure of bis(4-chloro-2-(((2-chloroethyl)imino)methyl)phenolato-κ2 N,O)-oxidovanadium(IV), C18H16Cl4N2O3V Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 651-653 |
| 8107251 | CIF | C19 H18 O2 | P b c a | 11.017; 12.14; 23.346 90; 90; 90 | 3122 | Li, Chongyu Crystal structure of 2-(tert-pentyl)anthracene-9,10-dione, C19H18O2 Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 917-919 |
| 8107255 | CIF | C13 H10 Cl N3 O2 | P b c a | 7.7316; 24.8021; 26.074 90; 90; 90 | 4999.9 | Tong, Jian-Ying; Sun, Na-Bo; Han, Liang; Liu, Xing-Hai Hydrogen bonded dimers in the crystal structure of 2-chloro-N-(phenylcarbamoyl)nicotinamide, C26H20Cl2N6O4 Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 929-931 |
| 8107267 | CIF | C26 H34 N2 | P b c a | 14.8062; 15.8918; 20.0121 90; 90; 90 | 4708.79 | Liu, Yingfan; Zhao, Zhiqiang Crystal structure of (Z)-2-(tert-butyl)-5-((5-(tert- butyl)-2H-pyrrol-2-ylidene)(mesityl)methyl)-1H-pyrrole, C26H34N2 Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 971-974 |
| 8107275 | CIF | C36 H36 Cd3 I2 N4 O8 | P b c a | 18.909; 16.149; 26.05 90; 90; 90 | 7955 | Hu, Jin; Lu, Xin-Hua Crystal structure of diiodido-bis(6,6′-dimethoxy-2,2′-(ethane-1,2-diylbis(nitrilomethanylylidene)) diphenolato)tricadmium(II), C36H36Cd3I2N4O8 Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 997-999 |
| 8107299 | CIF | C20 H15 F5 N2 O3 | P b c a | 10.9913; 11.0451; 30.3925 90; 90; 90 | 3689.6 | Wu, Yundeng; Xie, Jun; Wan, Hui; Xu, Xiangyang; Li, Jian The crystal structure of 5-(2-fluoro-3-methoxyphenyl)-1-(2-fluoro-6-(trifluoromethyl)benzyl)-6-methylpyrimidine-2,4(1H,3H)-dione, C20H15F5N2O3 Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 1083-1085 |
| 8107301 | CIF | C20 H12 Br2 Cu N2 O2 | P b c a | 7.7117; 18.7735; 24.8518 90; 90; 90 | 3597.93 | Yang, Jiao; Xu, Jiajun; Liao, Nichan; Wu, Qiong [2,2′-{Ethane-1,2-diylbis[(azanylylidene)methanylylidene]}bis(3-bromo-2-hydroxyphenyl)]iron(III) nitrate, C20H12Br2CuN2O2 Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 1091-1092 |
| 8107366 | CIF | C8 H10 N2 O2 | P b c a | 11.0571; 8.1172; 17.608 90; 90; 90 | 1580.37 | Gardiner, John M.; Raftery, James; Beadham, Ian G.; Azarah, Jannat N.; Abu-Foul, Mohammed Y.; Awadallah, Adel M.; Morjan, Rami Y. The crystal structure of methyl 3,5-diaminobenzoate, C8H10N2O2 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 109-110 |
| 8107384 | CIF | C20 H18 N4 O4 | P b c a | 7.67; 15.679; 29.17 90; 90; 90 | 3508 | Shin, Soon Young; Koh, Dongsoo The crystal structure of 2-(7-(2,3-dimethoxyphenyl)-[1,2,4]triazolo[1,5-a]-pyrimidin-5-yl)-3-methoxyphenol, C20H18N4O4 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 167-169 |
| 8107433 | CIF | C14 H11 F3 N6 O3 | P b c a | 8.0862; 15.473; 23.5892 90; 90; 90 | 2951.43 | Du, Yi-Jing; Sun, Hong-Shun; Wang, Jian-Qiang; Xu, Jia-Ying The crystal structure of 1-((1-methyl-1H-1,2,4-triazol-3-yl) methyl)-3-(2,4,5-trifluorobenzyl)-1,3,5-triazinane-2,4,6-trione, C14H11F3N6O3 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 339-340 |
| 8107448 | CIF | C18 H13 F N2 O2 | P b c a | 13.8082; 9.7555; 21.8116 90; 90; 90 | 2938.15 | Siyuan, Ma; Mengping, Guo The crystal structure of 1-(2-fluorobenzoyl)-5-methoxy-2-methyl-1H-indole-3-carbonitrile, C18H13FN2O2 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 385-387 |
| 8107460 | CIF | C21 H45 N9 O3 S2 | P b c a | 9.5299; 16.5181; 36.886 90; 90; 90 | 5806.4 | Tang, Huawei; Han, Qianqian; Liu, Lijuan Tetrabutylammonium 1,3,5-thiadiazole-5-amido-2-carbamate—1,2,4-thiadiazole-3,5-diamine— water (1/1/1), C21H45N9O3S2 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 429-431 |
| 8107521 | CIF | C11 H12 N2 O4 S | P b c a | 11.08447; 10.71473; 19.5463 90; 90; 90 | 2321.46 | Song, Jinqing; Cui, Beibei; Mi, Xia; Zhang, Jingyu Crystal structure of 3-(thiazol-2-ylcarbamoyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid, C11H12N2O4S Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 653-654 |
| 8107534 | CIF | C23 H24 N3 O4 Re S | P b c a | 15.1264; 15.1167; 20.15 90; 90; 90 | 4607.5 | Makhakhayi, Luleka; Malan, Frederick P.; Tembu, Vuyelwa J.; Nkambule, Comfort M.; Manicum, Amanda-Lee E. The crystal structure of fac-tricarbonyl(N-benzoyl-N,N-cyclohexylmethylcarbamimidothioato-κ2 S,O)-(pyridine-κN)rhenium(I), C23H24N3O4ReS Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 697-699 |
| 8107592 | CIF | C22 H18 Mg N4 O6 | P b c a | 15.3055; 15.1214; 18.1048 90; 90; 90 | 4190.19 | Xi-Shi, Tai; Hong-Chang, Li The crystal structure of [bis(2,2′-bipyridine-6-carboxylato-κ 3 N,N,O)magnesium(II)]dihydrate, C22H18N4O6Mg Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 887-889 |
| 8107610 | CIF | C16 H11 Cl2 F N2 | P b c a | 9.6732; 15.5602; 19.0881 90; 90; 90 | 2873.08 | Li, Yiting; Zhang, Xiaochun; Weng, Xingshang; Zhuang, Xuewen The crystal structure of 4-(2,4-dichlorophenyl)-2-(4-fluorophenyl)-5-methyl-1H-imidazole, C16H11Cl2FN2 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 957-958 |
| 8107633 | CIF | C21 H26 Au Cl N2 | P b c a | 8.7507; 15.8341; 29.9642 90; 90; 90 | 4151.82 | Huang, Yao-Huei; Lee, Hon Man Crystal structure of chlorido-(1,3-dimesitylimidazolidin-2-ylidene-κ1C)- gold(I), C21H26AuClN2 Zeitschrift für Kristallographie - New Crystal Structures, 2015, 230, 7-8 |
| 8107644 | CIF | C9 H11 Ca N O6 | P b c a | 15.954; 7.7489; 17.811 90; 90; 90 | 2201.9 | Zhao, Yan; Li, Shi-Hui; Zhang, Li Crystal structure of poly[μ4-2,6-dimethyl-pyridine-3,5-dicarboxylate- κ6O,O’:O’,O’’,O’’’:O’’’] calcium(II), C9H11CaNO6 Zeitschrift für Kristallographie - New Crystal Structures, 2015, 230, 31-32 |
| 8107684 | CIF | C10 H14 N4 | P b c a | 15.5356; 9.8551; 25.5551 90; 90; 90 | 3912.61 | Dali, Zhu; Yu, Yu Crystal structure of 6,6a,7,8,9,10-hexahydro-5H-pyrazino [2,3-e]pyrido[1,2-a]pyrazine, C10H14N4 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 1137-1139 |
| 8107690 | CIF | C20 H18 Cl F4 N3 O | P b c a | 12.5254; 12.6845; 24.149 90; 90; 90 | 3836.8 | Yu, Lu; Meng, Qing-Guo; Hou, Gui-Ge; Liu, Yong-Jun; Geng, Zi-Kai Crystal structure of 2-amino-4-(2-fluoro-3-(trifluoromethyl)phenyl)-9-methoxy-1,4,5,6-tetrahydrobenzo[h]quinazolin-3-ium chloride, C20H18ClF4N3O Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 1161-1163 |
| 8107716 | CIF | C21 H18 O4 S2 | P b c a | 8.2038; 19.881; 24.0661 90; 90; 90 | 3925.2 | Abdel-Aziz, Hatem A.; Ghabbour, Hazem A.; Fun, Hoong-Kun Crystal structure of (E)-3-(4-methoxyphenyl)-1-(thiophen-2-yl)-2- tosylprop-2-en-1-one, C21H18O4S2 Zeitschrift für Kristallographie - New Crystal Structures, 2015, 230, 61-62 |
| 9000240 | CIF | Ca0.04 Fe1.71 Mg0.25 O6 Si2 | P b c a | 18.405; 9.0338; 5.239 90; 90; 90 | 871.073 | Burnham, C. W.; Ohashi, Y.; Hafner, S. S.; Virgo, D. Cation distribution and atomic thermal vibrations in an iron-rich orthopyroxene American Mineralogist, 1971, 56, 850-876 |
| 9000250 | CIF | B6 H9 Mg O15 | P b c a | 12.54; 24.327; 7.48 90; 90; 90 | 2281.85 | Dal Negro, A.; Ungaretti, L.; Sabelli, C. The crystal structure of aksaite American Mineralogist, 1971, 56, 1553-1566 |
| 9000258 | CIF | As2 Ni | P b c a | 5.753; 5.799; 11.407 90; 90; 90 | 380.556 | Fleet, M. E. The crystal structure of pararammelsbergite (NiAs2) American Mineralogist, 1972, 57, 1-9 |
| 9000353 | CIF | Ca0.032 Fe1.331 Mg0.636 O6 Si2 | P b c a | 18.337; 8.971; 5.232 90; 90; 90 | 860.67 | Smyth, J. R. An orthopyroxene structure up to 850 C T = 20 C American Mineralogist, 1973, 58, 636-648 |
| 9000354 | CIF | Ca0.032 Fe1.332 Mg0.635 O6 Si2 | P b c a | 18.364; 8.988; 5.238 90; 90; 90 | 864.561 | Smyth, J. R. An orthopyroxene structure up to 850 C T = 175 C note temperature factors for O1b appear incorrect American Mineralogist, 1973, 58, 636-648 |
| 9000355 | CIF | Ca0.032 Fe1.331 Mg0.636 O6 Si2 | P b c a | 18.371; 9; 5.242 90; 90; 90 | 866.707 | Smyth, J. R. An orthopyroxene structure up to 850 C T = 280 C American Mineralogist, 1973, 58, 636-648 |
| 9000356 | CIF | Ca0.032 Fe1.332 Mg0.635 O6 Si2 | P b c a | 18.429; 9.028; 5.26 90; 90; 90 | 875.143 | Smyth, J. R. An orthopyroxene structure up to 850 C T = 500 C American Mineralogist, 1973, 58, 636-648 |
| 9000357 | CIF | Ca0.032 Fe1.332 Mg0.636 O6 Si2 | P b c a | 18.483; 9.053; 5.28 90; 90; 90 | 883.484 | Smyth, J. R. An orthopyroxene structure up to 850 C T = 700 C American Mineralogist, 1973, 58, 636-648 |
| 9000358 | CIF | Ca0.032 Fe0.65 Mg1.318 O6 Si2 | P b c a | 18.546; 9.081; 5.298 90; 90; 90 | 892.269 | Smyth, J. R. An orthopyroxene structure up to 850 C T = 850 C American Mineralogist, 1973, 58, 636-648 |
| 9000476 | CIF | Fe O3 Si | P b c a | 18.418; 9.078; 5.2366 90; 90; 90 | 875.552 | Sueno, S.; Cameron, M.; Prewitt, C. T. Orthoferrosilite: High-temperature crystal chemistry T = 24 deg C American Mineralogist, 1976, 61, 38-53 |
| 9000477 | CIF | Fe O3 Si | P b c a | 18.484; 9.124; 5.2593 90; 90; 90 | 886.971 | Sueno, S.; Cameron, M.; Prewitt, C. T. Orthoferrosilite: High-temperature crystal chemistry T = 400 deg C American Mineralogist, 1976, 61, 38-53 |
| 9000478 | CIF | Fe O3 Si | P b c a | 18.527; 9.145; 5.2756 90; 90; 90 | 893.842 | Sueno, S.; Cameron, M.; Prewitt, C. T. Orthoferrosilite: High-temperature crystal chemistry T = 600 deg C American Mineralogist, 1976, 61, 38-53 |
| 9000479 | CIF | Fe O3 Si | P b c a | 18.569; 9.16; 5.2974 90; 90; 90 | 901.046 | Sueno, S.; Cameron, M.; Prewitt, C. T. Orthoferrosilite: High-temperature crystal chemistry T = 800 deg C American Mineralogist, 1976, 61, 38-53 |
| 9000480 | CIF | Fe O3 Si | P b c a | 18.596; 9.1685; 5.3113 90; 90; 90 | 905.563 | Sueno, S.; Cameron, M.; Prewitt, C. T. Orthoferrosilite: High-temperature crystal chemistry T = 900 deg C American Mineralogist, 1976, 61, 38-53 |
| 9000481 | CIF | Fe O3 Si | P b c a | 18.614; 9.172; 5.3199 90; 90; 90 | 908.254 | Sueno, S.; Cameron, M.; Prewitt, C. T. Orthoferrosilite: High-temperature crystal chemistry T = 980 deg C American Mineralogist, 1976, 61, 38-53 |
| 9000571 | CIF | Al Ca H9 Mg O13 P2 | P b c a | 14.723; 18.746; 7.107 90; 90; 90 | 1961.51 | Moore, P. B.; Araki, T. Overite, segelerite, and jahnsite: a study in combinatorial polymorphism American Mineralogist, 1977, 62, 692-702 |
| 9000572 | CIF | Ca Fe H9 Mg O13 P2 | P b c a | 14.826; 18.751; 7.307 90; 90; 90 | 2031.36 | Moore, P. B.; Araki, T. Overite, segelerite, and jahnsite: a study in combinatorial polymorphism American Mineralogist, 1977, 62, 692-702 |
| 9000674 | CIF | Fe1.108 H2 Mg3.892 O18 Si6 | P b c a | 18.626; 27.23; 5.297 90; 90; 90 | 2686.56 | Veblen, D. R.; Burnham, C. W. New biopyriboles from Chester, Vermont: II. The crystal chemistry of jimthompsonite, clinojimthompsonite, and chesterite, and the amphibole-mica reaction American Mineralogist, 1978, 63, 1053-1073 |
| 9000918 | CIF | Mg1.47 Mn0.53 O6 Si2 | P b c a | 18.384; 8.878; 5.226 90; 90; 90 | 852.952 | Petersen, E. U.; Anovitz, L. M.; Essene, E. J. Donpeacorite, (Mn,Mg)MgSi2O6, a new orthopyroxene and its proposed phase relations in the system MnSiO3-MgSiO3-FeSiO3 American Mineralogist, 1984, 69, 472-480 |
| 9000957 | CIF | Ge Mg O3 | P b c a | 19.011; 9.084; 5.415 90; 90; 90 | 935.148 | Yamanaka, T.; Hirano, M.; Takeuchi, Y. A high temperature transition in MgGeO3 from clinopyroxene (C2/c) type to orthopyroxene (Pbca) type American Mineralogist, 1985, 70, 365-374 |
| 9000958 | CIF | Ge Mg O3 | P b c a | 18.829; 8.952; 5.347 90; 90; 90 | 901.275 | Yamanaka, T.; Hirano, M.; Takeuchi, Y. A high temperature transition in MgGeO3 from clinopyroxene (C2/c) type to orthopyroxene (Pbca) type American Mineralogist, 1985, 70, 365-374 |
| 9001178 | CIF | Ca0.052 Mg1.948 O6 Si2 | P b c a | 18.28; 8.834; 5.197 90; 90; 90 | 839.24 | Carlson, W. D.; Swinnea, J. S.; Miser, D. E. Stability of orthoenstatite at high temperature and low pressure American Mineralogist, 1988, 73, 1255-1263 |
| 9001208 | CIF | Fe0.106 Mg0.894 O3 Si | P b c a | 18.241; 8.804; 5.198 90; 90; 90 | 834.766 | Molin, G. M. Crystal-chemical study of cation disordering in Al-rich and Al-poor orthopyroxenes from spinel lherzolite xenoliths sample Le4A, natural American Mineralogist, 1989, 74, 593-598 |
| 9001209 | CIF | Fe0.105 Mg0.895 O3 Si | P b c a | 18.244; 8.805; 5.196 90; 90; 90 | 834.677 | Molin, G. M. Crystal-chemical study of cation disordering in Al-rich and Al-poor orthopyroxenes from spinel lherzolite xenoliths sample Le4A, 1050 C, 3 min American Mineralogist, 1989, 74, 593-598 |
| 9001210 | CIF | Fe0.108 Mg0.893 O3 Si | P b c a | 18.243; 8.808; 5.197 90; 90; 90 | 835.077 | Molin, G. M. Crystal-chemical study of cation disordering in Al-rich and Al-poor orthopyroxenes from spinel lherzolite xenoliths sample Le4A, 1050 C, 10 min American Mineralogist, 1989, 74, 593-598 |
| 9001211 | CIF | Fe0.105 Mg0.895 O3 Si | P b c a | 18.244; 8.805; 5.196 90; 90; 90 | 834.677 | Molin, G. M. Crystal-chemical study of cation disordering in Al-rich and Al-poor orthopyroxenes from spinel lherzolite xenoliths sample Le4A, 1050 C, 90 min American Mineralogist, 1989, 74, 593-598 |
| 9001212 | CIF | Fe0.106 Mg0.893 O3 Si | P b c a | 18.246; 8.809; 5.197 90; 90; 90 | 835.309 | Molin, G. M. Crystal-chemical study of cation disordering in Al-rich and Al-poor orthopyroxenes from spinel lherzolite xenoliths sample Le4A, 1150 C, 2 min American Mineralogist, 1989, 74, 593-598 |
| 9001213 | CIF | Fe0.106 Mg0.893 O3 Si | P b c a | 18.242; 8.803; 5.198 90; 90; 90 | 834.717 | Molin, G. M. Crystal-chemical study of cation disordering in Al-rich and Al-poor orthopyroxenes from spinel lherzolite xenoliths sample Le4A, 1150 C, 10 min American Mineralogist, 1989, 74, 593-598 |
| 9001214 | CIF | Fe0.085 Mg0.915 O3 Si | P b c a | 18.246; 8.828; 5.189 90; 90; 90 | 835.822 | Molin, G. M. Crystal-chemical study of cation disordering in Al-rich and Al-poor orthopyroxenes from spinel lherzolite xenoliths sample Le9A, natural American Mineralogist, 1989, 74, 593-598 |
| 9001215 | CIF | Fe0.084 Mg0.916 O3 Si | P b c a | 18.25; 8.83; 5.19 90; 90; 90 | 836.356 | Molin, G. M. Crystal-chemical study of cation disordering in Al-rich and Al-poor orthopyroxenes from spinel lherzolite xenoliths sample Le9A, 1050 C, 3 min American Mineralogist, 1989, 74, 593-598 |
| 9001216 | CIF | Fe0.086 Mg0.914 O3 Si | P b c a | 18.25; 8.829; 5.191 90; 90; 90 | 836.422 | Molin, G. M. Crystal-chemical study of cation disordering in Al-rich and Al-poor orthopyroxenes from spinel lherzolite xenoliths sample Le9A, 1050 C, 10 min American Mineralogist, 1989, 74, 593-598 |
| 9001217 | CIF | Fe0.086 Mg0.914 O3 Si | P b c a | 18.248; 8.831; 5.189 90; 90; 90 | 836.197 | Molin, G. M. Crystal-chemical study of cation disordering in Al-rich and Al-poor orthopyroxenes from spinel lherzolite xenoliths sample Le9A, 1050 C, 90 min American Mineralogist, 1989, 74, 593-598 |
| 9001218 | CIF | Fe0.087 Mg0.913 O3 Si | P b c a | 18.248; 8.832; 5.192 90; 90; 90 | 836.776 | Molin, G. M. Crystal-chemical study of cation disordering in Al-rich and Al-poor orthopyroxenes from spinel lherzolite xenoliths sample Le9A, 1150 C, 2 min American Mineralogist, 1989, 74, 593-598 |
| 9001219 | CIF | Fe0.086 Mg0.914 O3 Si | P b c a | 18.243; 8.834; 5.19 90; 90; 90 | 836.413 | Molin, G. M. Crystal-chemical study of cation disordering in Al-rich and Al-poor orthopyroxenes from spinel lherzolite xenoliths sample Le9A, 1150 C, 10 min American Mineralogist, 1989, 74, 593-598 |
| 9001564 | CIF | Ca1.67 H2 Mn0.33 O5 Si | P b c a | 9.398; 9.139; 10.535 90; 90; 90 | 904.833 | Dai, Y. S.; Harlow, G. E.; McGhie, A. R. Poldervaartite, Ca(Ca0.5Mn0.5)(SiO3OH)(OH), a new acid nesosilicate from the Kalahari manganese field, South Africa: Crystal structure and description American Mineralogist, 1993, 78, 1082-1087 |
| 9001577 | CIF | Fe0.44 Mg0.56 O3 Si | P b c a | 18.312; 8.917; 5.217 90; 90; 90 | 851.874 | Hazen, R. M.; Finger, L. W.; Ko, J. Effects of pressure on Mg-Fe ordering in orthopyroxene synthesized at 11.3 GPa and 1600 C American Mineralogist, 1993, 78, 1336-1339 |
| 9001593 | CIF | Mg O3 Si | P b c a | 18.233; 8.8191; 5.1802 90; 90; 90 | 832.969 | Hugh-Jones D A; Angel, R. J. A compressional study of MgSiO3 orthoenstatite up to 8.5 GPa Sample: P = 0 GPa American Mineralogist, 1994, 79, 405-410 |
| 9001594 | CIF | Mg O3 Si | P b c a | 18.186; 8.782; 5.161 90; 90; 90 | 824.26 | Hugh-Jones D A; Angel, R. J. A compressional study of MgSiO3 orthoenstatite up to 8.5 GPa Sample: P = 1.04 GPa American Mineralogist, 1994, 79, 405-410 |
| 9001595 | CIF | Mg O3 Si | P b c a | 18.148; 8.756; 5.1493 90; 90; 90 | 818.244 | Hugh-Jones D A; Angel, R. J. A compressional study of MgSiO3 orthoenstatite up to 8.5 GPa Sample: P = 1.95 GPa American Mineralogist, 1994, 79, 405-410 |
| 9001596 | CIF | Mg O3 Si | P b c a | 18.1045; 8.7181; 5.1327 90; 90; 90 | 810.129 | Hugh-Jones D A; Angel, R. J. A compressional study of MgSiO3 orthoenstatite up to 8.5 GPa Sample: P = 3.27 GPa American Mineralogist, 1994, 79, 405-410 |
| 9001597 | CIF | Mg O3 Si | P b c a | 18.071; 8.6929; 5.1214 90; 90; 90 | 804.518 | Hugh-Jones D A; Angel, R. J. A compressional study of MgSiO3 orthoenstatite up to 8.5 GPa Sample: P = 4.09 GPa American Mineralogist, 1994, 79, 405-410 |
| 9001598 | CIF | Mg O3 Si | P b c a | 18.0455; 8.6708; 5.1119 90; 90; 90 | 799.853 | Hugh-Jones D A; Angel, R. J. A compressional study of MgSiO3 orthoenstatite up to 8.5 GPa Sample: P = 4.95 GPa American Mineralogist, 1994, 79, 405-410 |
| 9001599 | CIF | Mg O3 Si | P b c a | 18.011; 8.652; 5.102 90; 90; 90 | 795.051 | Hugh-Jones D A; Angel, R. J. A compressional study of MgSiO3 orthoenstatite up to 8.5 GPa Sample: P = 5.85 GPa American Mineralogist, 1994, 79, 405-410 |
| 9001600 | CIF | Mg O3 Si | P b c a | 17.983; 8.6241; 5.0902 90; 90; 90 | 789.425 | Hugh-Jones D A; Angel, R. J. A compressional study of MgSiO3 orthoenstatite up to 8.5 GPa Sample: P = 7.00 GPa American Mineralogist, 1994, 79, 405-410 |
| 9001601 | CIF | Mg O3 Si | P b c a | 17.95; 8.604; 5.08 90; 90; 90 | 784.564 | Hugh-Jones D A; Angel, R. J. A compressional study of MgSiO3 orthoenstatite up to 8.5 GPa Sample: P = 8.10 GPa American Mineralogist, 1994, 79, 405-410 |
| 9001641 | CIF | Fe0.249 Mg0.751 O3 Si | P b c a | 18.2747; 8.8729; 5.1988 90; 90; 90 | 842.983 | Yang, H.; Ghose, S. A transitional structural state and anomalous Fe-Mg order-disorder in Mg-rich orthopyroxene, (Mg0.75Fe0.25)2Si2O6 T = 296 K American Mineralogist, 1995, 80, 9-20 |
| 9001642 | CIF | Fe0.249 Mg0.751 O3 Si | P b c a | 18.3878; 8.9577; 5.2441 90; 90; 90 | 863.768 | Yang, H.; Ghose, S. A transitional structural state and anomalous Fe-Mg order-disorder in Mg-rich orthopyroxene, (Mg0.75Fe0.25)2Si2O6 T = 1000 K American Mineralogist, 1995, 80, 9-20 |
| 9001643 | CIF | Fe0.249 Mg0.751 O3 Si | P b c a | 18.4105; 8.9691; 5.254 90; 90; 90 | 867.57 | Yang, H.; Ghose, S. A transitional structural state and anomalous Fe-Mg order-disorder in Mg-rich orthopyroxene, (Mg0.75Fe0.25)2Si2O6 T = 1100 K American Mineralogist, 1995, 80, 9-20 |
| 9001644 | CIF | Fe0.249 Mg0.751 O3 Si | P b c a | 18.4317; 8.9822; 5.2647 90; 90; 90 | 871.609 | Yang, H.; Ghose, S. A transitional structural state and anomalous Fe-Mg order-disorder in Mg-rich orthopyroxene, (Mg0.75Fe0.25)2Si2O6 T = 1200 K American Mineralogist, 1995, 80, 9-20 |
| 9001645 | CIF | Fe0.249 Mg0.751 O3 Si | P b c a | 18.5132; 8.9809; 5.3243 90; 90; 90 | 885.246 | Yang, H.; Ghose, S. A transitional structural state and anomalous Fe-Mg order-disorder in Mg-rich orthopyroxene, (Mg0.75Fe0.25)2Si2O6 T = 1300 K American Mineralogist, 1995, 80, 9-20 |
| 9001699 | CIF | Ca0.043 Fe0.807 Mg1.15 O6 Si2 | P b c a | 18.316; 8.907; 5.218 90; 90; 90 | 851.268 | Domeneghetti, M. C.; Molin, G. M.; Stimpfl, M.; Tribaudino, M. Orthopyroxene from the Serra de Mage meteorite: Structure refinement and estimation of C2/c pyroxene contributions to apparent Pbca diffraction violations Sample: OPX SDM N.13, natural American Mineralogist, 1995, 80, 923-929 |
| 9001700 | CIF | Ca0.043 Fe0.802 Mg1.155 O6 Si2 | P b c a | 18.32; 8.917; 5.219 90; 90; 90 | 852.573 | Domeneghetti, M. C.; Molin, G. M.; Stimpfl, M.; Tribaudino, M. Orthopyroxene from the Serra de Mage meteorite: Structure refinement and estimation of C2/c pyroxene contributions to apparent Pbca diffraction violations Sample: OPX SDM N.7, heated American Mineralogist, 1995, 80, 923-929 |
| 9001749 | CIF | Al0.028 Ca0.036 Cr0.004 Fe0.795 Mg1.134 Mn0.026 O6 Si1.986 Ti0.005 | P b c a | 18.316; 8.907; 5.218 90; 90; 90 | 851.268 | Domeneghetti, M. C.; Tazzoli, V.; Ballaran, T. B.; Molin, G. M. Orthopyroxene from the Serra de Mage meteorite: A structure-refinement procedure for a Pbca phase coexisting with a C2/c exsolved phase Sample Opx SDM N.13, natural American Mineralogist, 1996, 81, 842-846 |
| 9001750 | CIF | Al0.028 Ca0.036 Cr0.004 Fe0.801 Mg1.128 Mn0.026 O6 Si1.986 Ti0.005 | P b c a | 18.32; 8.917; 5.219 90; 90; 90 | 852.573 | Domeneghetti, M. C.; Tazzoli, V.; Ballaran, T. B.; Molin, G. M. Orthopyroxene from the Serra de Mage meteorite: A structure-refinement procedure for a Pbca phase coexisting with a C2/c exsolved phase Sample Opx SDM N.7, heated American Mineralogist, 1996, 81, 842-846 |
| 9001891 | CIF | H33 O48 Pb2 U10 | P b c a | 14.1165; 41.378; 14.5347 90; 90; 90 | 8489.9 | Burns, P. C. A new uranyl oxide hydrate sheet in vandendriesscheite: Implications for mineral paragenesis and the corrosion of spent nuclear fuel Locality: Shinkolobwe (Congo) American Mineralogist, 1997, 82, 1176-1186 |
| 9003378 | CIF | As H3 O5 Sr | P b c a | 7.4361; 8.4808; 14.348 90; 90; 90 | 904.843 | Jimenez, A.; Prieto, M.; Salvado, M. A.; Garcia-Granda S Structure and crystallization behavior of the (Ba,Sr)HAsO4.H2O solid-solution in aqueous environments American Mineralogist, 2004, 89, 601-609 |
| 9003379 | CIF | As Ba0.11 H3 O5 Sr0.89 | P b c a | 7.443; 8.477; 14.38 90; 90; 90 | 907.296 | Jimenez, A.; Prieto, M.; Salvado, M. A.; Garcia-Granda S Structure and crystallization behavior of the (Ba,Sr)HAsO4.H2O solid-solution in aqueous environments American Mineralogist, 2004, 89, 601-609 |
| 9003380 | CIF | As Ba H3 O5 | P b c a | 7.7519; 8.759; 14.668 90; 90; 90 | 995.941 | Jimenez, A.; Prieto, M.; Salvado, M. A.; Garcia-Granda S Structure and crystallization behavior of the (Ba,Sr)HAsO4.H2O solid-solution in aqueous environments American Mineralogist, 2004, 89, 601-609 |
| 9003574 | CIF | Al0.003 Ca0.024 Mg1.433 Mn0.541 O6 Si1.997 Ti0.002 | P b c a | 18.3668; 8.8725; 5.2289 90; 90; 90 | 852.099 | Stimpfl, M. The Mn, Mg-intracrystalline exchange reaction in donpeacorite (Mn0.54Ca0.03Mg1.43Si2O6) and its relation to the fractionation behavior of Mn in Fe, Mg-orthopyroxene Sample: untreated American Mineralogist, 2005, 90, 155-161 |
| 9003575 | CIF | Al0.003 Ca0.024 Mg1.433 Mn0.541 O6 Si1.997 Ti0.002 | P b c a | 18.3653; 8.8819; 5.2305 90; 90; 90 | 853.193 | Stimpfl, M. The Mn, Mg-intracrystalline exchange reaction in donpeacorite (Mn0.54Ca0.03Mg1.43Si2O6) and its relation to the fractionation behavior of Mn in Fe, Mg-orthopyroxene Sample: quenched from 980 deg C DIS American Mineralogist, 2005, 90, 155-161 |
| 9003576 | CIF | Al0.003 Ca0.024 Mg1.433 Mn0.542 O6 Si1.997 Ti0.002 | P b c a | 18.3686; 8.8828; 5.2287 90; 90; 90 | 853.139 | Stimpfl, M. The Mn, Mg-intracrystalline exchange reaction in donpeacorite (Mn0.54Ca0.03Mg1.43Si2O6) and its relation to the fractionation behavior of Mn in Fe, Mg-orthopyroxene Sample: quenched from 900 deg C DIS American Mineralogist, 2005, 90, 155-161 |
| 9003577 | CIF | Al0.003 Ca0.024 Mg1.433 Mn0.509 O6 Si1.997 Ti0.002 | P b c a | 18.3718; 8.8836; 5.2334 90; 90; 90 | 854.131 | Stimpfl, M. The Mn, Mg-intracrystalline exchange reaction in donpeacorite (Mn0.54Ca0.03Mg1.43Si2O6) and its relation to the fractionation behavior of Mn in Fe, Mg-orthopyroxene Sample: quenched from 904 deg C ORD American Mineralogist, 2005, 90, 155-161 |
| 9003578 | CIF | Al0.003 Ca0.024 Mg1.433 Mn0.541 O6 Si1.997 Ti0.002 | P b c a | 18.3645; 8.881; 5.2284 90; 90; 90 | 852.727 | Stimpfl, M. The Mn, Mg-intracrystalline exchange reaction in donpeacorite (Mn0.54Ca0.03Mg1.43Si2O6) and its relation to the fractionation behavior of Mn in Fe, Mg-orthopyroxene Sample: quenched from 856 deg C ORD American Mineralogist, 2005, 90, 155-161 |
| 9003579 | CIF | Al0.003 Ca0.024 Mg1.433 Mn0.541 O6 Si1.997 Ti0.002 | P b c a | 18.3559; 8.8741; 5.2256 90; 90; 90 | 851.209 | Stimpfl, M. The Mn, Mg-intracrystalline exchange reaction in donpeacorite (Mn0.54Ca0.03Mg1.43Si2O6) and its relation to the fractionation behavior of Mn in Fe, Mg-orthopyroxene Sample: quenched from 806 deg C ORD American Mineralogist, 2005, 90, 155-161 |
| 9004029 | CIF | Ca0.07 Mg1.93 O6 Si2 | P b c a | 18.2588; 8.8229; 5.1899 90; 90; 90 | 836.07 | Nestola, F.; Gatta, G. D.; Ballaran, T. B. The effect of Ca substitution on the elastic and structural behavior of orthoenstatite Sample: P = 0.0001 GPa American Mineralogist, 2006, 91, 809-815 |
| 9004030 | CIF | Ca0.07 Mg1.93 O6 Si2 | P b c a | 18.201; 8.768; 5.154 90; 90; 90 | 822.508 | Nestola, F.; Gatta, G. D.; Ballaran, T. B. The effect of Ca substitution on the elastic and structural behavior of orthoenstatite Sample: P = 1.76 GPa American Mineralogist, 2006, 91, 809-815 |
| 9004031 | CIF | Ca0.07 Mg1.93 O6 Si2 | P b c a | 18.093; 8.75; 5.127 90; 90; 90 | 811.675 | Nestola, F.; Gatta, G. D.; Ballaran, T. B. The effect of Ca substitution on the elastic and structural behavior of orthoenstatite Sample: P = 3.36 GPa American Mineralogist, 2006, 91, 809-815 |
| 9004032 | CIF | Ca0.07 Mg1.93 O6 Si2 | P b c a | 18.108; 8.7215; 5.12 90; 90; 90 | 808.596 | Nestola, F.; Gatta, G. D.; Ballaran, T. B. The effect of Ca substitution on the elastic and structural behavior of orthoenstatite Sample: P = 3.94 GPa American Mineralogist, 2006, 91, 809-815 |
| 9004033 | CIF | Ca0.07 Mg1.93 O6 Si2 | P b c a | 18.022; 8.6578; 5.085 90; 90; 90 | 793.417 | Nestola, F.; Gatta, G. D.; Ballaran, T. B. The effect of Ca substitution on the elastic and structural behavior of orthoenstatite Sample: P = 6.25 GPa American Mineralogist, 2006, 91, 809-815 |
| 9004094 | CIF | Co S Sb | P b c a | 5.842; 5.951; 11.666 90; 90; 90 | 405.577 | Rowland, J. F.; Gabe, E. J.; Hall, S. R. The crystal structures of costibite (CoSbS) and paracostibite(CoSbS) The Canadian Mineralogist, 1975, 13, 188-196 |
| 9004098 | CIF | C Ca O5 Te | P b c a | 6.988; 11.201; 10.566 90; 90; 90 | 827.028 | Fischer, R.; Pertlik, F.; Zemann, J. The crystal structure of mroseite, CaTeO2(CO3) The Canadian Mineralogist, 1975, 13, 383-387 |
| 9004117 | CIF | Mg O3 Si | P b c a | 18.216; 8.813; 5.179 90; 90; 90 | 831.424 | Hawthorne, F. C.; Ito, J. Synthesis and crystal-structure refinement of transition-metal orthopyroxenes I: Orthoenstatite and (Mg, Mn, Co) orthopyroxene The Canadian Mineralogist, 1977, 15, 321-338 |
| 9004118 | CIF | Co0.132 Mg0.781 Mn0.087 O3 Si | P b c a | 18.246; 8.839; 5.196 90; 90; 90 | 837.992 | Hawthorne, F. C.; Ito, J. Synthesis and crystal-structure refinement of transition-metal orthopyroxenes I: Orthoenstatite and (Mg, Mn, Co) orthopyroxene The Canadian Mineralogist, 1977, 15, 321-338 |
| 9004137 | CIF | O2 Ti | P b c a | 9.174; 5.449; 5.138 90; 90; 90 | 256.844 | Meagher, E. P.; Lager, G. A. Polyhedral thermal expansion in the TiO2 polymorphs: Refinement of the crystal structures of rutile and brookite at high temperature Sample at 25 degrees C The Canadian Mineralogist, 1979, 17, 77-85 |
| 9004138 | CIF | O2 Ti | P b c a | 9.175; 5.459; 5.149 90; 90; 90 | 257.894 | Meagher, E. P.; Lager, G. A. Polyhedral thermal expansion in the TiO2 polymorphs: Refinement of the crystal structures of rutile and brookite at high temperature Sample at 280 degrees C The Canadian Mineralogist, 1979, 17, 77-85 |
| 9004139 | CIF | O2 Ti | P b c a | 9.191; 5.463; 5.157 90; 90; 90 | 258.935 | Meagher, E. P.; Lager, G. A. Polyhedral thermal expansion in the TiO2 polymorphs: Refinement of the crystal structures of rutile and brookite at high temperature Sample at 425 degrees C The Canadian Mineralogist, 1979, 17, 77-85 |
| 9004140 | CIF | O2 Ti | P b c a | 9.211; 5.472; 5.171 90; 90; 90 | 260.632 | Meagher, E. P.; Lager, G. A. Polyhedral thermal expansion in the TiO2 polymorphs: Refinement of the crystal structures of rutile and brookite at high temperatures Sample at 625 degrees C The Canadian Mineralogist, 1979, 17, 77-85 |
| 9004189 | CIF | C H4 B O7 Sm0.1 Y0.9 | P b c a | 9.089; 12.244; 8.926 90; 90; 90 | 993.336 | Grice, J. D.; Ercit, T. S. The crystal structure of moydite The Canadian Mineralogist, 1986, 24, 675-678 |
| 9004230 | CIF | Ca2 O23 P2 U3 | P b c a | 17.415; 16.035; 13.598 90; 90; 90 | 3797.24 | Atencio, D.; Neumann, R.; Silva, A. J. G. C.; Mascarenhas, Y. P. Phurcalite from Perus, San Paulo, Brazil, and redetermination of its crystal structure The Canadian Mineralogist, 1991, 29, 95-105 |
| 9004396 | CIF | B Be2 H O4 | P b c a | 9.776; 12.194; 4.43 90; 90; 90 | 528.094 | Burns, P. C.; Novak, M.; Hawthorne, F. C. Fluorine-hydroxyl variation in hambergite: A crystal-structure study Note: sample HM1 The Canadian Mineralogist, 1995, 33, 1205-1213 |
| 9004397 | CIF | B Be2 H O4 | P b c a | 9.754; 12.231; 4.434 90; 90; 90 | 528.981 | Burns, P. C.; Novak, M.; Hawthorne, F. C. Fluorine-hydroxyl variation in hambergite: A crystal-structure study Note: sample HM2 The Canadian Mineralogist, 1995, 33, 1205-1213 |
| 9004398 | CIF | B Be2 H O4 | P b c a | 9.678; 12.313; 4.439 90; 90; 90 | 528.974 | Burns, P. C.; Novak, M.; Hawthorne, F. C. Fluorine-hydroxyl variation in hambergite: A crystal-structure study Note: sample HM3 The Canadian Mineralogist, 1995, 33, 1205-1213 |
| 9004399 | CIF | B Be2 H O4 | P b c a | 9.663; 12.364; 4.44 90; 90; 90 | 530.462 | Burns, P. C.; Novak, M.; Hawthorne, F. C. Fluorine-hydroxyl variation in hambergite: A crystal-structure study Note: sample HM4 The Canadian Mineralogist, 1995, 33, 1205-1213 |
| 9004400 | CIF | B Be2 H O4 | P b c a | 9.654; 12.347; 4.4364 90; 90; 90 | 528.81 | Burns, P. C.; Novak, M.; Hawthorne, F. C. Fluorine-hydroxyl variation in hambergite: A crystal-structure study Note: sample HM5 The Canadian Mineralogist, 1995, 33, 1205-1213 |
| 9004908 | CIF | Cs2 Mo2 O10 U | P b c a | 11.762; 14.081; 14.323 90; 90; 90 | 2372.19 | Krivovichev, S. V.; Burns, P. C. Crystal chemistry of the uranyl molybdates. XI. Crystal structures of Cs2[(UO2)(MoO4)2] and Cs2[(UO2)(MoO4)2](H2O) The Canadian Mineralogist, 2005, 43, 713-720 |
| 9005588 | CIF | Ca0.04 Mg1.96 O6 Si2 | P b c a | 18.262; 8.826; 5.192 90; 90; 90 | 836.849 | Nestola, F.; Tribaudino, M. The structure of Pbca orthopyroxenes along the join diopside-enstatite (CaMgSi2O6-Mg2Si2O6) Sample: D4En96 European Journal of Mineralogy, 2003, 15, 365-371 |
| 9005589 | CIF | Ca0.07 Mg1.93 O6 Si2 | P b c a | 18.268; 8.836; 5.196 90; 90; 90 | 838.718 | Nestola, F.; Tribaudino, M. The structure of Pbca orthopyroxenes along the join diopside-enstatite (CaMgSi2O6-Mg2Si2O6) Sample: D7E93 European Journal of Mineralogy, 2003, 15, 365-371 |
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