Crystallography Open Database
Search results
Result: there are 3278 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 'P c a 21'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 7715484 | CIF | C31 H52 B10 Ca N2 | P c a 21 | 21.5052; 11.9353; 13.8858 90; 90; 90 | 3564.1 | Pearce, Kyle G.; Morris, Louis J.; Robinson, Thomas P.; Johnson, Andrew L.; Mahon, Mary F.; Hill, Michael S. From alkaline earth to coinage metal carboranyls. Dalton transactions (Cambridge, England : 2003), 2024, 53, 6653-6659 |
| 7715572 | CIF | C44 H86 Co6 N6 O16 | P c a 21 | 12.6327; 15.366; 27.9274 90; 90; 90 | 5421.1 | Terlecki, Michał; Kornowicz, Arkadiusz; Sacharczuk, Kornel; Justyniak, Iwona; Lewiński, Janusz Synthesis, polymorphism, and shape complementarity-induced co-crystallization of hexanuclear Co(II) clusters capped by a flexible heteroligand shell. Dalton transactions (Cambridge, England : 2003), 2024, 53, 7012-7022 |
| 7715616 | CIF | C51 H69 F18 Gd O8 P2 | P c a 21 | 17.8798; 18.7861; 17.3285 90; 90; 90 | 5820.5 | Inage, Kota; Wang, Mengfei; Hasegawa, Yasuchika; Kitagawa, Yuichi Effective photosensitized emission of a Tb(III) complex using a β-diketonate photosensitizer and an oxygen barrier system in a thermally populated triplet state. Dalton transactions (Cambridge, England : 2003), 2024 |
| 7715617 | CIF | C51 H69 F18 O8 P2 Tb | P c a 21 | 17.91; 18.7471; 17.3371 90; 90; 90 | 5821.1 | Inage, Kota; Wang, Mengfei; Hasegawa, Yasuchika; Kitagawa, Yuichi Effective photosensitized emission of a Tb(III) complex using a β-diketonate photosensitizer and an oxygen barrier system in a thermally populated triplet state. Dalton transactions (Cambridge, England : 2003), 2024 |
| 7715651 | CIF | C52 H62 K2 Ni O8 | P c a 21 | 18.7188; 26.1144; 19.8447 90; 90; 90 | 9700.7 | Borys, Andryj M.; Vedani, Luca; Hevia, Eva The coordination of alkali-metal nickelates to organic π-systems: Synthetic, structural and spectroscopic insights Dalton Transactions, 2024 |
| 7715879 | CIF | C40 H36 Cl Ir N6 O | P c a 21 | 17.64348; 8.6604; 22.95688 90; 90; 90 | 3507.8 | Hashemzadeh, Tahmineh; Christofferson, Andrew Joseph; White, Keith Forrest; Barnard, Peter Experimental and Theoretical Studies of pH-Responsive Iridium(III) Complexes of Azole and N-Heterocyclic Carbene Ligands Dalton Transactions, 2024 |
| 7715953 | CIF | C35 H16 B F23 N2 | P c a 21 | 20.8363; 11.7036; 14.1501 90; 90; 90 | 3450.6 | Slesarchuk, Nikita; Ma, Enlu; Miranda-Pizarro, Juan; Heikkinen, Sami; Schollmeyer, Dieter; Nieger, Martin; Vasko, Petra; Repo, Timo On the mechanism of sp2 C-H borylation using ortho-N-substituted pyridinium cation Dalton Transactions, 2024 |
| 8000161 | CIF | C30 H25 N3 O3 | P c a 21 | 15.8386; 8.5314; 17.3856 90; 90; 90 | 2349.2 | Wang, Xiang-Shan; Zhang, Mei-Mei; Jiang, Hong; Yao, Chang-Sheng; Tu, Shu-Jiang Unexpected Spiro-benzoquinolines in the Reaction of N-(Arylidene)naphthalen-2-amine, Arylaldehyde, and 1,3-Dimethylbarbituric Acid in Water Chemistry Letters, 2007, 36, 450 |
| 8000169 | CIF | C52 H65 Cl Ir N2 P S W | P c a 21 | 21.684; 12.9161; 17.115 90; 90; 90 | 4793.4 | Arashiba, Kazuya; Tanabe, Yoshiaki; Ishii, Youichi Synthesis and Reactivities of Sulfido-bridged Ir‒W and Ir‒Re Heterodinuclear Complexes with Imido Ligands Chemistry Letters, 2007, 36, 622 |
| 8000533 | CIF | C6 H15 N3 O6 | P c a 21 | 21.5256; 9.7968; 4.7685 90; 90; 90 | 1005.59 | Guo, Mingxia; Rosbottom, Ian; Zhou, Lina; Yong, Chin W.; Zhou, Ling; Yin, Qiuxiang; Todorov, Ilian T.; Errington, Ethan; Heng, Jerry Y. Y. Triglycine (GGG) Adopts a Polyproline II (pPII) Conformation in Its Hydrated Crystal Form: Revealing the Role of Water in Peptide Crystallization. The journal of physical chemistry letters, 2021, 12, 8416-8422 |
| 8100480 | CIF | C10 H10 O3 | P c a 21 | 20.165; 5.6673; 7.5829 90; 90; 90 | 866.6 | Greatrex, B. W.; Taylor, D. K.; Tiekink, E. R. T. Crystal structure of (±)-[(2R,3S)-3-(hydroxymethyl)oxiran-2-yl](phenyl)- methanone, C~10~H~10~O~3~ Zeitschrift für Kristallographie - New Crystal Structures, 2003, 218, 561-562 |
| 8101113 | CIF | C26 H29 Co N7 O4 P | P c a 21 | 15.1046; 11.0696; 16.5588 90; 90; 90 | 2768.7 | Vogt, Martin; Schütt, Thomas; Kemmerich, Timm; Klapötke, Thomas M.; Beck, Wolfgang Crystal structure of trans-azido-bis(dimethylglyoximato)-triphenylphosphine- cobalt(III), C~26~H~29~CoN~7~O~4~P, at 200 K Zeitschrift für Kristallographie - New Crystal Structures, 2001, 216, 637-638 |
| 8101179 | CIF | C5 H5 N O S | P c a 21 | 11.588; 13.724; 7.522 90; 90; 90 | 1196.3 | Joannou, John; Martin, Lisandra L.; Taylor, Max R. Crystal structure of 2-thiophenealdoxime, C~5~H~5~NOS Zeitschrift für Kristallographie - New Crystal Structures, 2000, 215, 119-120 |
| 8101278 | CIF | C7 H8 Cd Hg N4 O2 S4 | P c a 21 | 16.4319; 7.3794; 13.4711 90; 90; 90 | 1633.5 | Zhou, Mei; Yu, Wen Tao; Xu, Dong; Guo, Shi Yi; Lu, Meng Kai; Yuan, Duo Rong Crystal structure of cadmium mercury tetrathiocyanate (glycol monomethyl ether), C~7~H~8~CdHgN~4~O~2~S~4~ Zeitschrift für Kristallographie - New Crystal Structures, 2000, 215, 425-426 |
| 8101370 | CIF | C19 H16 Cl N2 O S | P c a 21 | 8.1248; 19.1264; 21.7702 90; 90; 90 | 3383.1 | Öztürk, S.; Aygün, M.; Öcal, N.; Yolaçan, Ç.; Fun, H.-K. Crystal structure of 3-(p-chlorophenyl)-5-methyl-2-(8-quinolinyl)- 4-thiazolidinone, C~19~H~16~ClN~2~OS Zeitschrift für Kristallographie - New Crystal Structures, 2000, 215, 526-528 |
| 8101408 | CIF | C18 H34 N4 O14 Zr | P c a 21 | 17.379; 9.637; 30.759 90; 90; 90 | 5151.6 | Haussuühl, Eiken; Schreuer, Juergen Crystal structure of 1,5-diamino-2-methylpentane zirconium bis(nitrilotriacetate) dihydrate, NH~3~(CH~2~)~3~CHCH~3~CH~2~NH~3~ Zr[N(CH~2~COO)~3~]~2~ · 2H~2~O Zeitschrift für Kristallographie - New Crystal Structures, 1999, 214, 71-73 |
| 8101716 | CIF | C9 H19 N O8 P2 | P c a 21 | 24.348; 8.088; 7.623 90; 90; 90 | 1501.2 | Belam, W.; Khedhiri, L.; Daoud, A. Crystal structure of 2-ethyl-6-methylanilinium dihydrogenphosphate phosphoric acid, (C~9~H~14~N)H~2~PO~4~ · H~3~PO~4~ Zeitschrift für Kristallographie - New Crystal Structures, 2005, 220, 147-148 |
| 8102008 | CIF | C17 H16 N2 O2 | P c a 21 | 5.6406; 30.292; 16.925 90; 90; 90 | 2891.9 | Frey, W.; Shiva, S.; Jäger, V. Crystal structure of rel-(3aR,6aS)-6-methyl-3,6a-di-phenyl-3a,4,6, 6a-tetrahydro-isoxazolo[5,4-c]isoxazole, C~17~H~16~N~2~O~2~ Zeitschrift für Kristallographie - New Crystal Structures, 2006, 221, 349-351 |
| 8102086 | CIF | C34 H32 Ag2 N4 O12 | P c a 21 | 18.712; 16.926; 24.627 90; 90; 90 | 7800 | Wang, C.-C.; Ma, H.-W. Crystal structure of catena-(bis((1,3-bis(4-pyridyl)propane)-silver(I))) benzene-1,4-dicarboxylate octahydrate, [{Ag(C~13~H~14~N~2~)}~2~][C~8~H~4~O~4~] · 8H~2~O Zeitschrift für Kristallographie - New Crystal Structures, 2007, 222, 101-104 |
| 8102222 | CIF | C18 H24 O3 | P c a 21 | 11.9945; 17.309; 7.4999 90; 90; 90 | 1557.1 | Wefelscheid, Ulrike K.; Brüdgam, Irene; Hartl, Hans; Reißig, Hans-Ulrich Crystal structure of (8S*,9S*,13S*,14R*,17S*)-estra-1(10),2,4,6-tetraene- 14,17-diol monohydrate, C~18~H~22~O~2~ · H~2~O Zeitschrift für Kristallographie - New Crystal Structures, 2007, 222, 467-468 |
| 8102860 | CIF | C12 H20 Ag2 N6 O7 | P c a 21 | 20.769; 6.405; 12.187 90; 90; 90 | 1621.2 | Guang-Yi Wang; Zhen Ma; Bing Liu; Cun-Yuan Cao Crystal structure of aqua(hexamethylenetetraamine)-(pyrazine-2,3-dicarboxylato)disilver(I) dihydrate, Ag2(H2O)(C6H2N2O4)(C6H12N4) · 2H2O Zeitschrift für Kristallographie - New Crystal Structures, 2010, 225, 771 |
| 8102870 | CIF | C17 H17 Br N2 O2 | P c a 21 | 13.1672; 14.5045; 8.9452 90; 90; 90 | 1708.39 | Gerhard Laus; Volker Kahlenberg; Herwig Schottenberger Crystal structure of 1,3-di(benzyloxy)imidazolium bromide, [C17H17N2O2]Br Zeitschrift für Kristallographie - New Crystal Structures, 2010, 225, 759 |
| 8103173 | CIF | C23 H20 N4 O3 | P c a 21 | 19.43; 5.3621; 19.692 90; 90; 90 | 2051.6 | Wu-Lan Zeng Crystal structure of 1-(4-ethylphenyl)-2-nicotinoyl-3-(1H-benzo[d]-1,2,3-triazol-1-yl)-1-oxopropan, C23H20N4O3 Zeitschrift für Kristallographie - New Crystal Structures, 2011, 226, 407 |
| 8103190 | CIF | C12 H24 B Cu F4 N5 O3 | P c a 21 | 15.1807; 8.4114; 28.6983 90; 90; 90 | 3664.51 | Mei-Ye Jia; Hong-Yu Zhou; Shuang-Yan Wang; Feng-Mei Nie Crystal structure of (tris(2-aminoethyl)amine-N,N',N'')-(nicotinate-N)copper(II) tetrafluoroborate hydrate, [Cu(C6H18N4)(C6H4NO2)][BF4] • H2O Zeitschrift für Kristallographie - New Crystal Structures, 2011, 226, 608 |
| 8103248 | CIF | C7 H9 N3 O3 | P c a 21 | 17.3539; 4.02431; 12.3842 90; 90; 90 | 864.88 | Gerhard Laus; Volker Kahlenberg; Wolfgang Reischl; Herwig Schottenberger Crystal structure of (E)-2-(1-methoxyimidazol-2-yl)-2-oxoacetaldehyde O-methyl oxime, C7H9N3O3 Zeitschrift für Kristallographie - New Crystal Structures, 2011, 226, 623 |
| 8103491 | CIF | B7 Br Mn3 O13 | P c a 21 | 8.7099; 8.6861; 12.314 90; 90; 90 | 931.616 | Kubel, F.; Crottaz, O. Crystal structure of manganese bromine boracite, Mn3 B7 O13 Br Zeitschrift fuer Kristallographie (149,1979-), 1996, 211, 924-924 |
| 8103659 | CIF | C H2 Na2 O4 | P c a 21 | 10.743; 5.254; 6.453 90; 90; 90 | 364.231 | Harper, J.P. Crystal structure of sodium carbonate monohydrate, Na2 C O3 H2 O Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1936, 95, 266-273 |
| 8104092 | CIF | F H Hg O3 Te | P c a 21 | 7.896; 6.7845; 6.8641 90; 90; 90 | 367.713 | Weil, M. Dimorphism in mercury(II) tellurite(IV) tellurate(VI): preparation and crystal structures of alpha- and beta- (Hg2 Te2 O7) Zeitschrift fuer Kristallographie (149,1979-), 2003, 218, 691-698 |
| 8104130 | CIF | Cs2 N12 Zn | P c a 21 | 21.98; 6.79; 7.45 90; 90; 90 | 1111.87 | Platzer, G.F.; Krischner, H. Die Kristallstruktur von Caesiumzinkazid Cs2 Zn (N3)4 Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1975, 141, 363-374 |
| 8104817 | CIF | C14 H10 Br Cl N2 O2 | P c a 21 | 32.4137; 4.6683; 8.8873 90; 90; 90 | 1344.8 | Xu, Xindi; Ma, Xun; Huang, Meifen; Li, Tianyu; Wu, Qiong Crystal structure of (E)-4-bromo-N′-(3-chloro-2-hydroxybenzylidene)benzohydrazide, C14H10BrClN2O2 Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 317-318 |
| 8104882 | CIF | C13 H11 N O | P c a 21 | 23.801; 6.051; 7.2677 90; 90; 90 | 1046.7 | Hosten, Eric C.; Betz, Richard Crystal structure of N,N-diphenylformamide, C13H11NO Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 57-59 |
| 8104892 | CIF | C6 H6 O3 S | P c a 21 | 15.3524; 5.718; 15.3395 90; 90; 90 | 1346.58 | Manana, Pholani; Hosten, Eric C.; Betz, Richard Crystal structure of benzenesulphonic acid Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 97-99 |
| 8104933 | CIF | C14 H9 N O2 | P c a 21 | 27.19; 4.3317; 17.297 90; 90; 90 | 2037.2 | Wang, Li-Hua; Zhou, Xiao-Jing; Liu, Li-Li; Zhang, Ai-Ling; Tai, Xi-Shi The crystal structure of 5H-dibenzo[b,e]azepine-6,11-dione, C14H9NO2 Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 243-244 |
| 8104936 | CIF | C14 H14 Br N3 O3 | P c a 21 | 32.932; 5.849; 7.3606 90; 90; 90 | 1417.8 | Li-Hua, Wang; Xiao-Jing, Zhou; Li-Li, Liu; Ai-Ling, Zhang; Xi-Shi, Tai The crystal structure of (E)-2-(5-bromo-2-hydroxybenzylidene)-N-phenylhydrazine-1- carboxamide monohydrate, C14H14BrN3O3 Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 251-252 |
| 8104967 | CIF | C30 H20 Cl2 N2 O4 S2 | P c a 21 | 16.9808; 7.5227; 20.8027 90; 90; 90 | 2657.4 | Jia, Li-Mei; Luo, Peng; Pan, Wei-Gao Crystal structure of 2-chloro-3-((thiophen-2-ylmethyl)amino)naphthalene-1,4-dione, C30H20O4N2Cl2S2 Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 81-83 |
| 8105230 | CIF | C15 H10 O3 | P c a 21 | 10.2949; 11.1616; 19.2902 90; 90; 90 | 2216.6 | Mzozoyana, Vuyisa; Zamisa, Sizwe J. Crystal structure of 7-hydroxy-4-phenyl-2H-chromen-2-one, C15H10O3 Zeitschrift für Kristallographie - New Crystal Structures, 2020, 235, 595-597 |
| 8105288 | CIF | C13 H21 N O5 | P c a 21 | 19.718; 9.102; 8.091 90; 90; 90 | 1452.1 | Liguo, Yang; Zhen, Zhang; Yongsheng, Niu; Fang, Wang; Dayong, Tian The crystal structure of (E)-2-((2-hydroxy-4-ethoxybenzylidene)amino)-2-methylpropane-1,3-diol monohydrate, C13H21NO5 Zeitschrift für Kristallographie - New Crystal Structures, 2020, 235, 789-791 |
| 8105327 | CIF | C15 H15 N3 O2 | P c a 21 | 7.9831; 10.6486; 15.7222 90; 90; 90 | 1336.53 | Mossine, Valeri V.; Kelley, Steven P.; Mawhinney, Thomas P. Crystal structure of (E)-3-methoxy-N′-(1-(pyridin-2-yl)ethylidene)benzohydrazide, C15H15N3O2 Zeitschrift für Kristallographie - New Crystal Structures, 2020, 235, 907-909 |
| 8105375 | CIF | C25 H18 F3 N O3 S | P c a 21 | 19.1142; 11.6722; 9.239 90; 90; 90 | 2061.26 | Zhang, Jia-Jing; Chen, Dian-Xing; Lv, Liang-Yan; Qi, Cong-Hui; Xu, Wei-Cheng; Hou, Gui-Ge Crystal structure and anti-inflammatory activity of (3E,5E)-3,5-bis(2-fluorobenzylidene)-1-((4-fluorophenyl)sulfonyl)piperidin-4-one, C25H18F3NO3S Zeitschrift für Kristallographie - New Crystal Structures, 2020, 235, 1051-1053 |
| 8105552 | CIF | C23 H17 N O4 | P c a 21 | 26.3525; 3.8864; 34.8871 90; 90; 90 | 3573.01 | Weng, Ai-Zhen; Quan, Hai-Yuan; Wang, Liu-Yang; She, Dong-Mei; Mei, Xiang-Dong Crystal structure of (2Z,2′Z)-1,1′-(pyridine-2,6-diyl) bis(3-hydroxy-3-phenylprop-2-en-1-one), C23H17NO4 Zeitschrift für Kristallographie - New Crystal Structures, 2018, 234, 91-93 |
| 8105626 | CIF | C34 H34 Br N5 O2 | P c a 21 | 21.36266; 11.83583; 12.09985 90; 90; 90 | 3059.38 | Xing, Ai-Ping; Zeng, Dai; Wang, Xin-Ling Crystal structure of (E)-2-(((6-bromopyridin-2-yl)methylene)amino)-3′,6′-bis(diethylamino)spiro[isoindoline-1,9′-xanthen]-3-one, C34H34N5O2Br Zeitschrift für Kristallographie - New Crystal Structures, 2019, 234, 309-311 |
| 8105712 | CIF | C27 H27 Cu N3 O7 | P c a 21 | 22.9142; 7.3271; 14.7386 90; 90; 90 | 2474.5 | Xu, Xingman; Sun, Renqiang Crystal structure of (2,2′-((naphthalen-1-ylmethyl)azanediyl)diacetato-κ3 N,O,O′)-(1,10-phenanthroline-κ2 N,N′)-copper(II) trihydrate, CuC27H27N3O7 Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 417-419 |
| 8105801 | CIF | C14 H19 N3 | P c a 21 | 22.2821; 10.8464; 10.8509 90; 90; 90 | 2622.45 | Yerima, Iliya B.; Zamisa, Sizwe J.; Bala, Muhammad D. Crystal structure of 4-tert-butyl-1-(2,6-dimethylphenyl)-1H-1,2,3-triazole, C14H19N3 Zeitschrift für Kristallographie - New Crystal Structures, 2019, 234, 625-627 |
| 8106181 | CIF | C26 H22 N2 O | P c a 21 | 22.8108; 9.8328; 8.7361 90; 90; 90 | 1959.46 | Zhu, Pingting; Zhou, Jiaojiao Crystal structure of (S)-1-(5-(anthracen-9-yl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl)propan-1-one, C26H22N2O Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 455-456 |
| 8106423 | CIF | C17 H21 Cl N2 S | P c a 21 | 25.4796; 6.7503; 18.9971 90; 90; 90 | 3267.4 | Al-Omary, Fatmah A. M.; Al-Rasheed, Lamees S.; Ghabbour, Hazem A.; El-Emam, Ali A. Crystal structure of 1-(adamantan-1-yl)-3-(3-chlorophenyl)thiourea, C17H21ClN2S Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 33-35 |
| 8106483 | CIF | C16 H18 N2 O3 | P c a 21 | 14.3074; 8.5321; 12.2534 90; 90; 90 | 1495.8 | Radi, Smaail; Tighadouini, Said; Eddike, Driss; Tillard, Monique; Mabkhot, Yahia N. Crystal structure of (Z)-1-(1,5-dimethyl-1H-pyrazol-3-yl)-3-(4-ethoxyphenyl)-3-hydroxyprop-2-en-1-one, C16H18N2O3 Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 207-208 |
| 8106709 | CIF | C24 H32 B Fe N10 O2 | P c a 21 | 19.053; 9.0666; 16.439 90; 90; 90 | 2839.8 | Ni, Zhong-Hai; Sun, Hao Crystal structure of tris(cyano-(hydrogen tris(3,5-dimethylpyrazolyl)borate))-iron(III) 4-methoxypyridinium monohydrate, C24H32BN10O2Fe Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 885-887 |
| 8106716 | CIF | C15 H24 N2 O4 | P c a 21 | 18.528; 8.123; 20.797 90; 90; 90 | 3130 | Yuan, Lin; Li, Zhong-Yan; Yuan, Xian-You; Zhang, Min Crystal structure of (E)-5-(diethylamino)-2-(((1,1,2-trihydroxyethyl)iminio)methyl)phenolate, C15H24N2O4 Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 905-907 |
| 8106794 | CIF | C17 H22 B N3 O7 | P c a 21 | 19.5516; 4.8474; 19.3396 90; 90; 90 | 1832.9 | Ge, Chunhua; Liu, Juanjuan; Xü, Zhe; Zhang, Yang; Zhang, Xiangdong Crystal structure of (E)-4-nitro-2-(((3-(tetrahydro-8λ4-[1,3,2]oxazaborolo[2,3-b][1,3,2]oxaborol-8-yl)phenyl)imino)methyl)phenol – water (1/2), C17H18BN3O5·2H2O Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 89-91 |
| 8106829 | CIF | C14 H12 O4 | P c a 21 | 22.6015; 7.1344; 7.3789 90; 90; 90 | 1189.83 | Benites, Julio; Valderrama, Jaime A.; Ríos, David; Cárdenas, Alejandro; Brito, Iván Crystal structure of (2,5-dihydroxyphenyl)-(4-methoxyphenyl)methanone, C14H12O4 Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 213-214 |
| 8106836 | CIF | C21 H14 Cl N | P c a 21 | 7.686; 10.161; 19.899 90; 90; 90 | 1554.1 | Van Tonder, Johannes; Visser, Hendrik G.; Koen, Renier The crystal structure of 6-chloro-2,4-diphenylquinoline Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 233-235 |
| 8106844 | CIF | C21 H26 Co N2 O9 | P c a 21 | 16.387; 12.389; 11.167 90; 90; 90 | 2267.1 | Xing-Hong, Chang Crystal structure of catena-poly-(diaqua-(μ 2-1,2-bis(4-pyridyl)ethene-κ2 N:N′)-(4-methylphthalato-κ2 O,O′)-cobalt(II)trihydrate, C21H26CoN2O9 Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 259-261 |
| 8107233 | CIF | C30 H34 Cl4 N8 Zn | P c a 21 | 20.235; 6.5462; 27.386 90; 90; 90 | 3627.6 | Liu, Hui-Jin The crystal structure of dichlorido-bis((RS)-2-(4-chlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)hexanenitrile-κ1 N)zinc(II), C30H34Cl4N8Zn Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 849-851 |
| 8107286 | CIF | C36 H26 Te | P c a 21 | 13.5004; 13.5677; 14.2006 90; 90; 90 | 2601.12 | Shibuya, Yuga; Koguchi, Shinichi; Oba, Makoto Crystal structure of di([1,1′:3′,1″-terphenyl]-2′-yl)tellane, C36H26Te Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 1037-1039 |
| 8107332 | CIF | C10 H11 N5 O2 | P c a 21 | 22.6173; 4.873; 9.9921 90; 90; 90 | 1101.27 | Nie, Jing; Jiahui, Mou; Wenxiang, Wang The crystal structure of 1-methyl-N-(1-methyl-1H-imidazole-2-carbonyl)-1H-imidazole-2-carboxamide, C10H11N5O2 Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 1195-1196 |
| 8107519 | CIF | C18 H42 Cl N5 Ni O7 | P c a 21 | 14.27; 9.918; 17.603 90; 90; 90 | 2491.4 | Zhang, Zu-Jiao; Ou, Guang-Chuan Crystal structure of (glycinto-κ 2 O,N ′)-[5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane-κ 4 N,N ′,N ″,N ‴]nickel(II) perchlorate monohydrate C18H42ClN5NiO7 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 645-647 |
| 8107643 | CIF | C13 H11 Br O | P c a 21 | 6.0941; 7.3417; 24.394 90; 90; 90 | 1091.41 | Hosten, Eric C.; Betz, Richard Crystal structure of 4-bromo-4’-methoxy-biphenyl, at 200 K, C13H11BrO Zeitschrift für Kristallographie - New Crystal Structures, 2015, 230, 29-30 |
| 9000133 | CIF | As Co S | P c a 21 | 5.582; 5.582; 5.582 90; 90; 90 | 173.928 | Giese, R. F.; Kerr, P. F. The crystal structures of ordered and disordered cobaltite ordered, annealed after heating in a vacuum at 450 C American Mineralogist, 1965, 50, 1002-1014 |
| 9000781 | CIF | H2 O10 S Sb4 | P c a 21 | 5.766; 11.274; 14.887 90; 90; 90 | 967.743 | Manchetti, S.; Sabelli, C. The crystal structure of klebelsbergite Sb4O4(OH)2SO4 American Mineralogist, 1980, 65, 931-935 |
| 9000864 | CIF | As Co S | P c a 21 | 5.592; 5.587; 5.567 90; 90; 90 | 173.927 | Bayliss, P. A further crystal structure refinement of cobaltite American Mineralogist, 1982, 67, 1048-1057 |
| 9000865 | CIF | As1.04 Co0.27 Fe0.19 Ni0.54 S0.96 | P c a 21 | 5.622; 5.622; 5.622 90; 90; 90 | 177.694 | Bayliss, P. A further crystal structure refinement of gersdorffite Sample: M15861 American Mineralogist, 1982, 67, 1058-1064 |
| 9001248 | CIF | Ir S Sb | P c a 21 | 6.025; 6.025; 6.025 90; 90; 90 | 218.711 | Bayliss, P. Crystal chemistry and crystallography of some minerals within the pyrite group American Mineralogist, 1989, 74, 1168-1176 |
| 9001675 | CIF | H4 Mn2 O6 Si | P c a 21 | 12.672; 7.217; 5.341 90; 90; 90 | 488.455 | Nyfeler, D.; Armbruster, T.; Dixon, R.; Bermanec, V. Nchwaningite, Mn2SiO3(OH)2.H2O, a new pyroxene-related chain silicate from the N'chwaning mine, Kalahari manganese field, South Africa American Mineralogist, 1995, 80, 377-386 |
| 9004218 | CIF | As Co S | P c a 21 | 5.5833; 5.5892; 5.5812 90; 90; 90 | 174.168 | Fleet, M. E.; Burns, P. C. Structure and twinning of cobaltite The Canadian Mineralogist, 1990, 28, 719-723 |
| 9007725 | CIF | C6 Cl Cu N3 O2 | P c a 21 | 24.97; 4.009; 9.116 90; 90; 90 | 912.555 | Norman, R. E.; Rose, N. J.; Stenkamp, R. E. Mono-amino-acid-copper complexes: syntheses and structures of chloro(glycinato)(methanol)copper(II) and chloro(glycinato) (1-methylimidazole)copper(II) Acta Crystallographica, Section C, 1990, 46, 1-6 |
| 9007869 | CIF | C45 As2 O8 Ru3 | P c a 21 | 30.385; 10.047; 14.402 90; 90; 90 | 4396.62 | Fun, H. K.; Bin Shawkataly, O.; Teohs, S. G. The structure of 1,1,1,2,2,2,3,3-octacarbonyl-u-(1-3-n-cyclododeca-1,6,9- trien-1-yl-3-ylidene)-2,3-u-hydrido-3-[(As,As,As',As'-tetraphenyl)methylenebis (arsine)-As]-triangula-triruthenium(0)(3 Ru-Ru) Acta Crystallographica, Section C, 1990, 46, 2329-2331 |
| 9007984 | CIF | Cs2 O15 Si6 Th | P c a 21 | 16.292; 7.2154; 13.68 90; 90; 90 | 1608.13 | Woodward, J. D.; Almond, P. M.; Albrecht-Schmitt T E Caesium thorium silicate, Cs2ThSi6O15 Acta Crystallographica, Section E, 2005, 61, i58-i60 |
| 9008222 | CIF | B7 Cl Mg3 O13 | P c a 21 | 8.5496; 8.5496; 12.091 90; 90; 90 | 883.8 | Dowty, E.; Clark, J. R. Crystal-structure refinements for orthorhombic boracite, Mg3B7O13Cl, and a trigonal, iron-rich analogue Note: [.25 .25 0] added to all atoms to move origin to screw axis Zeitschrift fur Kristallographie, 1973, 138, 64-99 |
| 9008435 | CIF | B7 Cl Mn3 O13 | P c a 21 | 8.678; 8.688; 12.29 90; 90; 90 | 926.598 | Kubel, F.; Crottaz, O. Crystal structure of manganese chlorine boracite, Mn3B7O13Cl Zeitschrift fur Kristallographie, 1996, 211, 924-924 |
| 9011141 | CIF | O5 Te U | P c a 21 | 10.161; 5.363; 7.862 90; 90; 90 | 428.427 | Meunier, G.; Galy, J. Structure cristalline de la schmitterite synthetique UTeO5 Acta Crystallographica, Section B, 1973, 29, 1251-1255 |
| 9011351 | CIF | Bi2 Mo O6 | P c a 21 | 5.4822; 16.1986; 5.5091 90; 90; 90 | 489.23 | Teller, R. G.; Brazdil, J. F.; Grasselli, R. K.; Jorgensen, J. D. The structure of gamma-bismuth molybdate, Bi2MoO6, by powder neutron diffraction Locality: synthetic Acta Crystallographica, Section C, 1984, 40, 2001-2005 |
| 9011799 | CIF | Bi2 O6 W | P c a 21 | 5.43726; 16.43018; 5.45842 90; 90; 90 | 487.629 | Knight, K. S. The crystal structure of russellite; a re-determination using neutron powder diffraction of synthetic Bi2WO6 Mineralogical Magazine, 1992, 56, 399-409 |
| 9012852 | CIF | O S8 | P c a 21 | 13.197; 7.973; 8.096 90; 90; 90 | 851.859 | Luger, P.; Bradaczek, H.; Steudel, R.; Rebsch, M. Rontgenstrukturanalyse von cyclooctaschwefeloxid Chemische Berichte, 1976, 109, 180-184 |
| 9013820 | CIF | B16 Ca4 H62 O59 | P c a 21 | 12.161; 40.477; 10.1843 90; 90; 90 | 5013.13 | Cooper, M. A.; Hawthorne, F. C.; Galliski, M. A.; Marquez-Zavalia M F The crystal structure of alfredstelznerite, Ca4(H2O)4[B4O4(OH)6]4(H2O)15, a complex hydroxy-hydrated calcium borate mineral The Canadian Mineralogist, 2010, 48, 129-138 |
| 9014871 | CIF | B7 Cl Mg3 O13 | P c a 21 | 8.54; 8.54; 12.07 90; 90; 90 | 880.284 | Ito, T.; Morimoto, N.; Sadanaga, R. The crystal structure of boracite Acta Crystallographica, 1951, 4, 310-316 |
| 9016323 | CIF | C H2 Cu O10 Pb3 Te | P c a 21 | 10.6522; 9.163; 9.6011 90; 90; 90 | 937.126 | Kampf, A. R.; Mills, S. J.; Housley, R. M.; Marty, J. Lead-tellurium oxysalts from Otto Mountain near Baker, California: IX. Agaite, Pb3Cu2+Te6+O5(OH)2(CO3), a new mineral with CuO5-TeO6 polyhedral sheets American Mineralogist, 2013, 98, 512-517 |
| 9016767 | CIF | Al0.012 Ca0.008 Fe0.008 H4 Mg0.106 Mn1.85 O6 Si | P c a 21 | 12.672; 7.217; 5.341 90; 90; 90 | 488.455 | Nyfeler, D.; Armbruster, T.; Dixon, R.; Bermanec, V. Nchwaningite, Mn2SiO3(OH)2.H2O, a new pyroxene-related chain silicate from the N'chwaning mine, Kalahari manganese field, South Africa American Mineralogist, 1995, 80, 377-386 |
| 9017091 | CIF | H2 O10 S Sb4 | P c a 21 | 5.7563; 11.2538; 14.8627 90; 90; 90 | 962.809 | Roper, A. J.; Leverett, P.; Murphy, T. D.; Williams, P. A.; Hibbs, D. E. Klebelsbergite, Sb4O4SO4(OH)2: Stability relationships, formation in nature, and refinement of its structure American Mineralogist, 2015, 100, 602-607 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!