Crystallography Open Database
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Searching space group like 'C 1 2 1'
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1000082 | CIF | Al6 F21 Na Rb2 | C 1 2 1 | 12.075; 6.972; 10.214 90; 113.2; 90 | 790.4 | Le Bail, A; Gao, Y; Jacoboni, C Crystal structure of Rb~2~NaAl~6~F~21~; a new term of the A~2~Na(Al~x~F~3x+1~)~3~ family (A= Rb, Cs) European Journal of Solid State Inorganic Chemistry, 1989, 26, 281-288 |
1001329 | CIF | Co F6 H6 Np O3 | C 1 2 1 | 12.119; 6.908; 7.928 90; 92.84; 90 | 662.9 | Abazli, H; Cousson, A; Jove, J; Pages, M; Gasperin, M Les composes Co Np F~6~ (H~2~ O)~3~ et Co U F~6~ (H~2~ O)~3~. Etude structurale, mesur des susceptibilites magnetiques et resonance Moessbauer (^237^Np) Journal of the Less-Common Metals, 1984, 96, 23-33 |
1001347 | CIF | B2 Ca O10 U2 | C 1 2 1 | 16.512; 8.169; 6.582 90; 96.97; 90 | 881.3 | Gasperin, M Synthese et structure du borouranate de calcium: Ca B~2~ U~2~ O~10~. Acta Crystallographica C (39,1983-), 1987, 43, 1247-1250 |
1004008 | CIF | Cr Cu P2 Se6 | C 1 2 1 | 6.221; 10.7702; 6.935 90; 107.09; 90 | 444.14 | Bourdon, X.; Maisonneuve, V.; Cajipe, V. B.; Payen, C.; Fischer, J. E. Copper sublattice ordering in layered Cu M P~2~ Se~6~ (M = In, Cr) Journal of Alloys and Compounds, 1999, 283, 122-127 |
1010519 | CIF | Po | C 1 2 1 | 7.42; 4.29; 14.1 90; 92; 90 | 448.6 | Rollier, M A; Hendricks, S B; Maxwell, L R The Crystal Structure of Polonium by Electron Diffraction Journal of Chemical Physics, 1936, 4, 648-652 |
1010868 | CIF | Al6 Ca2 H16 Na2 O38 Si9 | C 1 2 1 | 56.7; 6.54; 18.44 90; 90; 90 | 6837.9 | Hey, M H; Bannister, F A Studies on the Zeolites. Part V. Mesolite. Mineralogical Magazine and Journal of the Mineralogical Society (1876- 1968), 1933, 23, 421-447 |
1100380 | CIF | C27 H30 N2 | C 1 2 1 | 33.466; 6.977; 9.89 90; 96.73; 90 | 2293.33 | Reetz, Manfred T.; Kayser, Frank; Harms, Klaus Stereoselective synthesis of β-amino nitriles and 1,3-diamines Tetrahedron Letters, 1994, 35, 8769-8772 |
1101098 | CIF | C65 H85 N15 O35 | C 1 2 1 | 39.54; 8.72; 22.89 90; 95.26; 90 | 7859 | Jarmula, Adam; Rypniewski, Wojciech R.; Felczak, Krzysztof; Rode, Wojciech Struct. Chem., 2005, 541-549 |
1101099 | CIF | C13 H16 F N3 O7 | C 1 2 1 | 21.72; 8.72; 8.61 90; 90.42; 90 | 1631 | Jarmula, Adam; Rypniewski, Wojciech R.; Felczak, Krzysztof; Rode, Wojciech Struct. Chem., 2005, 541-549 |
1101100 | CIF | C15 H24 O2 | C 1 2 1 | 12.925; 6.367; 16.628 90; 98.07; 90 | 1354.8 | Alejandro F. Barrero; María M. Herrador; Ramón J. Álvarez-Manzaneda; Miguel Quirós; Armando Lara; José Quílez del Moral Longipinene derivatives from Santolina Viscosa Journal of Natural Products, 2000, 63, 587-591 |
1500046 | CIF | C40 H52 Ag2 F6 N O7 P S4 | C 1 2 1 | 23.8522; 7.531; 14.0178 90; 106.009; 90 | 2420.4 | Yoon, Il; Lee, Yoon Hee; Lee, Shim Sung; Lee, Sang Cheol; Park, Sung Bae S2O2 donor cyclic and acyclic ionophores: Potentiometric sensing for Ag(i) and a new nitrate-bridged dimeric Ag(i) complex of the acyclic ionophore with an unusual structure The Analyst, 2001, 126, 1773 |
1501843 | CIF | C30 H48 O5 | C 1 2 1 | 31.391; 7.212; 12.407 90; 103.261; 90 | 2734 | Huang, Hong-Li; Wang, Chun-Ming; Wang, Zhen-Hua; Yao, Ming-Jun; Han, Guang-Tian; Yuan, Ji-Cheng; Gao, Kun; Yuan, Cheng-Shan Tirucallane-type triterpenoids from Dysoxylum lenticellatum. Journal of natural products, 2011, 74, 2235-2242 |
1501844 | CIF | C27 H38 O5 | C 1 2 1 | 31.267; 6.8755; 14.753 90; 111.429; 90 | 2952.3 | Huang, Hong-Li; Wang, Chun-Ming; Wang, Zhen-Hua; Yao, Ming-Jun; Han, Guang-Tian; Yuan, Ji-Cheng; Gao, Kun; Yuan, Cheng-Shan Tirucallane-type triterpenoids from Dysoxylum lenticellatum. Journal of natural products, 2011, 74, 2235-2242 |
1501865 | CIF | C51 H44 O5 S2 | C 1 2 1 | 20.063; 10.21; 21.815 90; 89.42; 90 | 4468 | Antczak, Monika I.; Cai, Feng; Ready, Joseph M. Asymmetric synthesis of tertiary benzylic alcohols. Organic letters, 2011, 13, 184-187 |
1501911 | CIF | C23 H26 N4 O5 | C 1 2 1 | 17.639; 13.026; 12.1899 90; 122.269; 90 | 2368.2 | Yang, Zhigang; Wang, Zhen; Bai, Sha; Liu, Xiaohua; Lin, Lili; Feng, Xiaoming Asymmetric α-amination of 4-substituted pyrazolones catalyzed by a chiral Gd(OTf)3/N,N'-dioxide complex: highly enantioselective synthesis of 4-amino-5-pyrazolone derivatives. Organic letters, 2011, 13, 596-599 |
1501979 | CIF | C12 H15 Cl O3 S | C 1 2 1 | 15.176; 9.6244; 8.8976 90; 94.396; 90 | 1295.8 | Emerson, Christopher R.; Zakharov, Lev N.; Blakemore, Paul R. Iterative stereospecific reagent-controlled homologation using a functionalized α-chloroalkyllithium: synthesis of cyclic targets related to epibatidine. Organic letters, 2011, 13, 1318-1321 |
1502003 | CIF | C32 H70 O14 | C 1 2 1 | 50.084; 5.9938; 13.2247 90; 105.051; 90 | 3833.8 | Abbet, Christian; Neuburger, Markus; Wagner, Trixie; Quitschau, Melanie; Hamburger, Matthias; Potterat, Olivier Phyteumosides A and B: new saponins with unique triterpenoid aglycons from Phyteuma orbiculare L. Organic letters, 2011, 13, 1354-1357 |
1502141 | CIF | C28 H26 Br N O2 | C 1 2 1 | 23.306; 5.8518; 17.515 90; 91.215; 90 | 2388.2 | Cao, Ziping; Liu, Yilin; Liu, Zhaoqun; Feng, Xiangqing; Zhuang, Minyang; Du, Haifeng Pd-catalyzed asymmetric allylic alkylation of indoles and pyrroles by chiral alkene-phosphine ligands. Organic letters, 2011, 13, 2164-2167 |
1502153 | CIF | C17 H22 F3 N O3 S | C 1 2 1 | 16.766; 9.077; 12.502 90; 107.494; 90 | 1815 | Yoshida, Akiko; Hattori, Gaku; Miyake, Yoshihiro; Nishibayashi, Yoshiaki Copper-catalyzed enantioselective propargylic amination of nonaromatic propargylic esters with amines. Organic letters, 2011, 13, 2460-2463 |
1502163 | CIF | C38 H56 N2 O2 | C 1 2 1 | 30.274; 12.6304; 9.3737 90; 97.186; 90 | 3556.1 | White, James D.; Shaw, Subrata cis-2,5-Diaminobicyclo[2.2.2]octane, a new scaffold for asymmetric catalysis via salen-metal complexes. Organic letters, 2011, 13, 2488-2491 |
1502300 | CIF | C16 H21.5 N6.5 O7 | C 1 2 1 | 53.785; 8.059; 18.4575 90; 107.258; 90 | 7640.3 | Williams, David E.; Dalisay, Doralyn S.; Patrick, Brian O.; Matainaho, Teatulohi; Andrusiak, Kerry; Deshpande, Raamesh; Myers, Chad L.; Piotrowski, Jeff S.; Boone, Charles; Yoshida, Minoru; Andersen, Raymond J. Padanamides A and B, highly modified linear tetrapeptides produced in culture by a Streptomyces sp. isolated from a marine sediment. Organic letters, 2011, 13, 3936-3939 |
1502345 | CIF | C17 H15 Br O | C 1 2 1 | 18.9697; 6.1032; 12.078 90; 95.162; 90 | 1392.67 | Ovalles, Stephanie R.; Hansen, Jørn H; Davies, Huw M. L. Thermally induced cycloadditions of donor/acceptor carbenes. Organic letters, 2011, 13, 4284-4287 |
1502435 | CIF | C128 H93 F4 N8 O25 | C 1 2 1 | 23.8735; 10.3412; 23.7886 90; 107.843; 90 | 5590.45 | Shi, Feng; Luo, Shi-Wei; Tao, Zhong-Lin; He, Long; Yu, Jie; Tu, Shu-Jiang; Gong, Liu-Zhu The catalytic asymmetric 1,3-dipolar cycloaddition of ynones with azomethine ylides. Organic letters, 2011, 13, 4680-4683 |
1502489 | CIF | C38 H32 N4 O19 | C 1 2 1 | 21.77; 12.9719; 14.4182 90; 94.7022; 90 | 4058 | Peng, Wenjie; Jayasuriya, Anushka B.; Imamura, Akihiro; Lowary, Todd L. Synthesis of the 6-O-methyl-D-glycero-α-L-gluco-heptopyranose moiety present in the capsular polysaccharide from Campylobacter jejuni NCTC 11168. Organic letters, 2011, 13, 5290-5293 |
1502506 | CIF | C14 H20 Cl N O3 S | C 1 2 1 | 23.5483; 5.9268; 11.3734 90; 104.05; 90 | 1539.85 | Zhong, Cheng; Wang, Yikai; Hung, Alvin W.; Schreiber, Stuart L.; Young, Damian W. Diastereoselective control of intramolecular aza-Michael reactions using achiral catalysts. Organic letters, 2011, 13, 5556-5559 |
1502524 | CIF | C15 H18 O4 | C 1 2 1 | 10.00787; 26.3372; 10.8051 90; 99.8553; 90 | 2805.97 | Anderson, Katie; Calo, Frederick; Pfaffeneder, Toni; White, Andrew J. P.; Barrett, Anthony G. M. Biomimetic total synthesis of angelicoin A and B via a palladium-catalyzed decarboxylative prenylation-aromatization sequence. Organic letters, 2011, 13, 5748-5750 |
1502623 | CIF | C74 H84 Cl2 N6 P2 Ru | C 1 2 1 | 24.264; 24.798; 26.166 90; 104.12; 90 | 15268 | Goto, Mitsutaka; Konishi, Takahiro; Kawaguchi, Shinji; Yamada, Masatoshi; Nagata, Toshiaki; Yamano, Mitsuhisa Process Research on the Asymmetric Hydrogenation of a Benzophenone for Developing the Manufacturing Process of the Squalene Synthase Inhibitor TAK-475 Organic Process Research & Development, 2011, 15, 1178 |
1502666 | CIF | C19 H28 B10 O | C 1 2 1 | 24.701; 6.5249; 18.081 90; 131.621; 90 | 2178.5 | Beer, Michael L.; Lemon, Jennifer; Valliant, John F. Preparation and evaluation of carborane analogues of tamoxifen. Journal of medicinal chemistry, 2010, 53, 8012-8020 |
1502715 | CIF | C54 H70 Cl4 Cu2 N12 O23 | C 1 2 1 | 35.166; 8.308; 22.479 90; 101.477; 90 | 6436 | Hirva, Pipsa; Nielsen, Anne; Bond, Andrew D.; McKenzie, Christine J. Potential cross-linking transition metal complexes (M = Ni, Cu, Zn) in the ligand-modified LNA duplexes. The journal of physical chemistry. B, 2010, 114, 11942-11948 |
1502821 | CIF | C22 H28 O6 | C 1 2 1 | 17.066; 6.9212; 19.004 90; 100.536; 90 | 2206.9 | Wang, Qi; Chen, Tzu-Hsuan; Bastow, Kenneth F.; Lee, Kuo-Hsiung; Chen, Dao-Feng Altaicalarins A-D, cytotoxic bisabolane sesquiterpenes from Ligularia altaica. Journal of natural products, 2010, 73, 139-142 |
1502872 | CIF | C22 H25 N O2 | C 1 2 1 | 20.425; 8.0342; 11.639 90; 102.867; 90 | 1862 | Solomon, Marissa R.; Sivaguru, J.; Jockusch, Steffen; Adam, Waldemar; Turro, Nicholas J. Decoding stereocontrol during the photooxygenation of oxazolidinone-functionalized enecarbamates. Organic letters, 2010, 12, 2142-2145 |
1502883 | CIF | C20 H19 Cl N2 O2 | C 1 2 1 | 17.1435; 10.1913; 10.6419 90; 109.586; 90 | 1751.71 | Wang, Xu-Fan; Chen, Jia-Rong; Cao, Yi-Ju; Cheng, Hong-Gang; Xiao, Wen-Jing An enantioselective approach to highly substituted tetrahydrocarbazoles through hydrogen bonding-catalyzed cascade reactions. Organic letters, 2010, 12, 1140-1143 |
1503158 | CIF | C22 H35 N3 O6 S Si | C 1 2 1 | 31.131; 7.805; 22.844 90; 110.163; 90 | 5210.4 | Kelley, Brandon T.; Joullié, Madeleine M Ring opening of a trisubstituted aziridine with amines: regio- and stereoselective formation of substituted 1,2-diamines. Organic letters, 2010, 12, 4244-4247 |
1503178 | CIF | C18 H19 Br N2 O | C 1 2 1 | 18.7232; 6.9539; 14.145 90; 120.22; 90 | 1591.39 | Holloway, Chloe A.; Muratore, Michael E.; Storer, R. Lan; Dixon, Darren J. Direct enantioselective Brønsted acid catalyzed N-acyliminium cyclization cascades of tryptamines and ketoacids. Organic letters, 2010, 12, 4720-4723 |
1503304 | CIF | C30 H40 N4 O7 | C 1 2 1 | 23.844; 6.1411; 23.447 90; 110.722; 90 | 3211.2 | Krow, Grant R.; Liu, Nian; Sender, Matthew; Lin, Guoliang; Centafont, Ryan; Sonnet, Philip E.; DeBrosse, Charles; Ross, 3rd, Charles W; Carroll, Patrick J.; Shoulders, Matthew D.; Raines, Ronald T. Oligomers of a 5-carboxy-methanopyrrolidine β-amino acid. A search for order. Organic letters, 2010, 12, 5438-5441 |
1503390 | CIF | C25 H29 N O3 | C 1 2 1 | 15.457; 9.311; 15.892 90; 110.108; 90 | 2147.8 | Caron, Pierre-Yves; Deslongchamps, Pierre Versatile strategy to access tricycles related to quassinoids and triterpenes. Organic letters, 2010, 12, 508-511 |
1503464 | CIF | C16 H16 O5 | C 1 2 1 | 17.48; 7.99; 12.93 90; 132.34; 90 | 1335 | Sun, Hao-Fen; Li, Xiao-Ming; Meng, Li; Cui, Chuan-Ming; Gao, Shu-Shan; Li, Chun-Shun; Huang, Cai-Guo; Wang, Bin-Gui Asperolides A-C, Tetranorlabdane Diterpenoids from the Marine Alga-Derived Endophytic Fungus Aspergillus wentii EN-48. Journal of natural products, 2012, 75, 148-152 |
1503521 | CIF | C25 H25 N O2 | C 1 2 1 | 27.33; 5.2842; 14.3245 90; 100.363; 90 | 2035 | Trost, Barry M.; Bringley, Dustin A.; Seng, Pamela S. Enantioselective palladium-catalyzed [3 + 2] cycloadditions of trimethylenemethane with nitroalkenes. Organic letters, 2012, 14, 234-237 |
1503540 | CIF | C16 H18 O6 | C 1 2 1 | 16.6297; 8.0075; 10.8932 90; 91.258; 90 | 1450.21 | Asai, Teigo; Chung, Yu-Ming; Sakurai, Hiroaki; Ozeki, Tomoji; Chang, Fang-Rong; Yamashita, Kouwa; Oshima, Yoshiteru Tenuipyrone, a novel skeletal polyketide from the entomopathogenic fungus, Isaria tenuipes, cultivated in the presence of epigenetic modifiers. Organic letters, 2012, 14, 513-515 |
1503691 | CIF | C21 H34 O4 | C 1 2 1 | 17.854; 7.164; 16.135 90; 107.171; 90 | 1971.8 | Chen, Jian-Jun; Li, Zheng-Ming; Gao, Kun; Chang, Jin; Yao, Xiao-Jun Vladimuliecins A and B: cytotoxic pentacyclic pregnanols from Vladimiria muliensis. Journal of natural products, 2009, 72, 1128-1132 |
1503695 | CIF | C31 H50 O4 | C 1 2 1 | 12.3341; 7.3877; 30.799 90; 97.604; 90 | 2781.7 | Chen, Wen-Hao; Qi, Huan-Yang; Shi, Yan-Ping 24-Hydroxyoleanane-type triterpenes from the aerial parts and roots of Oxytropis falcata. Journal of natural products, 2009, 72, 1410-1413 |
1503778 | CIF | C41.25 H50 O13.13 | C 1 2 1 | 39.015; 9.2033; 23.6697 90; 101.259; 90 | 8335.4 | Boone, Matthew A.; McDonald, Frank E.; Lichter, Joseph; Lutz, Stefan; Cao, Rui; Hardcastle, Kenneth I. 1,5-Alpha-D-mannoseptanosides, ring-size isomers that are impervious to alpha-mannosidase-catalyzed hydrolysis. Organic letters, 2009, 11, 851-854 |
1503879 | CIF | C15 H27 N O2 S2 | C 1 2 1 | 19.68; 6.923; 15.753 90; 125.7; 90 | 1742.9 | Checa, Begoña; Gálvez, Erik; Parelló, Ricard; Sau, Miriam; Romea, Pedro; Urpí, Fèlix; Font-Bardia, Mercè; Solans, Xavier New approach to the stereoselective synthesis of tertiary methyl ethers. Organic letters, 2009, 11, 2193-2196 |
1503880 | CIF | C22 H52 Br2 P4 Pd2 | C 1 2 1 | 18.1731; 10.7733; 17.5878 90; 93.105; 90 | 3438.4 | Ogura, Tomokazu; Yoshida, Kazuhiro; Yanagisawa, Akira; Imamoto, Tsuneo Optically active dinuclear palladium complexes containing a Pd-Pd bond: preparation and enantioinduction ability in asymmetric ring-opening reactions. Organic letters, 2009, 11, 2245-2248 |
1503901 | CIF | C26 H25 Br O4 | C 1 2 1 | 21.672; 6.034; 18.445 90; 111.168; 90 | 2249.3 | Nair, Vijay; Babu, Beneesh P.; Vellalath, Sreekumar; Varghese, Vimal; Raveendran, Anabha E.; Suresh, Eringathodi Nucleophilic heterocyclic carbene catalyzed annulation of enals to chalcones in methanol: a stereoselective synthesis of highly functionalized cyclopentanes. Organic letters, 2009, 11, 2507-2510 |
1503961 | CIF | C24 H50 O5 Si4 | C 1 2 1 | 25.1341; 9.5269; 16.8986 90; 128.434; 90 | 3169.6 | Bower, Justin; Box, Matthew R.; Czyzewski, Michal; Goeta, Andres E.; Steel, Patrick G. Acyl polysilanes: new acyl anion equivalents for additions to electron-deficient alkenes. Organic letters, 2009, 11, 2744-2747 |
1504084 | CIF | C17 H24 N2 O4 | C 1 2 1 | 23.342; 5.7712; 17.317 90; 130.887; 90 | 1763.6 | Duguet, Nicolas; Slawin, Alexandra M. Z.; Smith, Andrew D. An asymmetric hetero-claisen approach to 3-alkyl-3-aryloxindoles. Organic letters, 2009, 11, 3858-3861 |
1504096 | CIF | C23 H34 O4 | C 1 2 1 | 26.323; 6.1374; 13.3377 90; 96.461; 90 | 2141.1 | Chin, Yen-Jin; Wang, Shun-Yi; Loh, Teck-Peng Synthesis of iriomoteolide-1a C13-C23 fragment via asymmetric conjugate addition and Julia-Kocienski coupling reaction. Organic letters, 2009, 11, 3674-3676 |
1504185 | CIF | C16 H18 O4 | C 1 2 1 | 18.1933; 7.711; 12.4502 90; 129.39; 90 | 1349.87 | Hanessian, Stephen; Boyer, Nicolas; Reddy, Gone Jayapal; Deschênes-Simard, Benoît Total synthesis of oidiodendrolides and related norditerpene dilactones from a common precursor: metabolites CJ-14,445, LL-Z1271gamma, oidiolactones A, B, C, and D, and nagilactone F. Organic letters, 2009, 11, 4640-4643 |
1504187 | CIF | C17 H20 O5 | C 1 2 1 | 18.1525; 7.6684; 12.0226 90; 101.178; 90 | 1641.81 | Hanessian, Stephen; Boyer, Nicolas; Reddy, Gone Jayapal; Deschênes-Simard, Benoît Total synthesis of oidiodendrolides and related norditerpene dilactones from a common precursor: metabolites CJ-14,445, LL-Z1271gamma, oidiolactones A, B, C, and D, and nagilactone F. Organic letters, 2009, 11, 4640-4643 |
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