Crystallography Open Database

Result : There are 3523 entries in the selection

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Searching space group like 'C 1 2 1'

COD ID: 1000082
CIF file Formula: - Al6 F21 Na Rb2 -
Comments: 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 26 (1989) 281-288
Space group: C 1 2 1
Cell volume: 790.4
Cell parameters: 12.075; 6.972; 10.214; 90; 113.2; 90;  

COD ID: 1001329
CIF file Formula: - Co F6 H6 Np O3 -
Comments: 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 96 (1984) 23-33
Space group: C 1 2 1
Cell volume: 662.9
Cell parameters: 12.119; 6.908; 7.928; 90; 92.84; 90;  

COD ID: 1001347
CIF file Formula: - B2 Ca O10 U2 -
Comments: Gasperin, M Synthese et structure du borouranate de calcium: Ca B~2~ U~2~ O~10~. Acta Crystallographica C (39,1983-) 43 (1987) 1247-1250
Space group: C 1 2 1
Cell volume: 881.3
Cell parameters: 16.512; 8.169; 6.582; 90; 96.97; 90;  

COD ID: 1004008
CIF file Formula: - Cr Cu P2 Se6 -
Comments: 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 283(1-2) (1999) 122-127
Space group: C 1 2 1
Cell volume: 444.14
Cell parameters: 6.221; 10.7702; 6.935; 90; 107.09; 90;  

COD ID: 1010519
CIF file Formula: - Po -
Comments: Rollier, M A; Hendricks, S B; Maxwell, L R The Crystal Structure of Polonium by Electron Diffraction Journal of Chemical Physics 4 (1936) 648-652
Space group: C 1 2 1
Cell volume: 448.6
Cell parameters: 7.42; 4.29; 14.1; 90; 92; 90;  

COD ID: 1010868
CIF file Formula: - Al6 Ca2 H16 Na2 O38 Si9 -
Comments: Hey, M H; Bannister, F A Studies on the Zeolites. Part V. Mesolite. Mineralogical Magazine and Journal of the Mineralogical Society (1876- 1968) 23 (1933) 421-447
Space group: C 1 2 1
Cell volume: 6837.9
Cell parameters: 56.7; 6.54; 18.44; 90; 90; 90;  

COD ID: 1100380
CIF file Formula: - C27 H30 N2 -
Comments: Reetz, Manfred T.; Kayser, Frank; Harms, Klaus Stereoselective synthesis of β-amino nitriles and 1,3-diamines Tetrahedron Letters 35(47) (1994) 8769-8772
Space group: C 1 2 1
Cell volume: 2293.33
Cell parameters: 33.466; 6.977; 9.89; 90; 96.73; 90;  

COD ID: 1101098
CIF file Formula: - C65 H85 N15 O35 -
Comments: Jarmula, Adam; Rypniewski, Wojciech R.; Felczak, Krzysztof; Rode, Wojciech Struct. Chem. 16 (5) (2005) 541-549
Space group: C 1 2 1
Cell volume: 7859
Cell parameters: 39.54; 8.72; 22.89; 90; 95.26; 90;  

COD ID: 1101099
CIF file Formula: - C13 H16 F N3 O7 -
Comments: Jarmula, Adam; Rypniewski, Wojciech R.; Felczak, Krzysztof; Rode, Wojciech Struct. Chem. 16 (5) (2005) 541-549
Space group: C 1 2 1
Cell volume: 1631
Cell parameters: 21.72; 8.72; 8.61; 90; 90.42; 90;  

COD ID: 1101100
CIF file Formula: - C15 H24 O2 -
Comments: 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 63 (2000) 587-591
Space group: C 1 2 1
Cell volume: 1354.8
Cell parameters: 12.925; 6.367; 16.628; 90; 98.07; 90;  

COD ID: 1500046
CIF file Formula: - C40 H52 Ag2 F6 N O7 P S4 -
Comments: 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 126(10) (2001) 1773
Space group: C 1 2 1
Cell volume: 2420.4
Cell parameters: 23.8522; 7.531; 14.0178; 90; 106.009; 90;  

COD ID: 1501843
CIF file Formula: - C30 H48 O5 -
Comments: 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 74(10) (2011) 2235-2242
Space group: C 1 2 1
Cell volume: 2734
Cell parameters: 31.391; 7.212; 12.407; 90; 103.261; 90;  

COD ID: 1501844
CIF file Formula: - C27 H38 O5 -
Comments: 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 74(10) (2011) 2235-2242
Space group: C 1 2 1
Cell volume: 2952.3
Cell parameters: 31.267; 6.8755; 14.753; 90; 111.429; 90;  

COD ID: 1501865
CIF file Formula: - C51 H44 O5 S2 -
Comments: Antczak, Monika I.; Cai, Feng; Ready, Joseph M. Asymmetric synthesis of tertiary benzylic alcohols. Organic letters 13(2) (2011) 184-187
Space group: C 1 2 1
Cell volume: 4468
Cell parameters: 20.063; 10.21; 21.815; 90; 89.42; 90;  

COD ID: 1501911
CIF file Formula: - C23 H26 N4 O5 -
Comments: 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 13(4) (2011) 596-599
Space group: C 1 2 1
Cell volume: 2368.2
Cell parameters: 17.639; 13.026; 12.1899; 90; 122.269; 90;  

COD ID: 1501979
CIF file Formula: - C12 H15 Cl O3 S -
Comments: 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 13(6) (2011) 1318-1321
Space group: C 1 2 1
Cell volume: 1295.8
Cell parameters: 15.176; 9.6244; 8.8976; 90; 94.396; 90;  

COD ID: 1502003
CIF file Formula: - C32 H70 O14 -
Comments: 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 13(6) (2011) 1354-1357
Space group: C 1 2 1
Cell volume: 3833.8
Cell parameters: 50.084; 5.9938; 13.2247; 90; 105.051; 90;  

COD ID: 1502141
CIF file Formula: - C28 H26 Br N O2 -
Comments: 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 13(9) (2011) 2164-2167
Space group: C 1 2 1
Cell volume: 2388.2
Cell parameters: 23.306; 5.8518; 17.515; 90; 91.215; 90;  

COD ID: 1502153
CIF file Formula: - C17 H22 F3 N O3 S -
Comments: Yoshida, Akiko; Hattori, Gaku; Miyake, Yoshihiro; Nishibayashi, Yoshiaki Copper-catalyzed enantioselective propargylic amination of nonaromatic propargylic esters with amines. Organic letters 13(9) (2011) 2460-2463
Space group: C 1 2 1
Cell volume: 1815
Cell parameters: 16.766; 9.077; 12.502; 90; 107.494; 90;  

COD ID: 1502163
CIF file Formula: - C38 H56 N2 O2 -
Comments: 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 13(9) (2011) 2488-2491
Space group: C 1 2 1
Cell volume: 3556.1
Cell parameters: 30.274; 12.6304; 9.3737; 90; 97.186; 90;  

COD ID: 1502300
CIF file Formula: - C16 H21.5 N6.5 O7 -
Comments: 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 13(15) (2011) 3936-3939
Space group: C 1 2 1
Cell volume: 7640.3
Cell parameters: 53.785; 8.059; 18.4575; 90; 107.258; 90;  

COD ID: 1502345
CIF file Formula: - C17 H15 Br O -
Comments: Ovalles, Stephanie R.; Hansen, Jørn H; Davies, Huw M. L. Thermally induced cycloadditions of donor/acceptor carbenes. Organic letters 13(16) (2011) 4284-4287
Space group: C 1 2 1
Cell volume: 1392.67
Cell parameters: 18.9697; 6.1032; 12.078; 90; 95.162; 90;  

COD ID: 1502435
CIF file Formula: - C128 H93 F4 N8 O25 -
Comments: 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 13(17) (2011) 4680-4683
Space group: C 1 2 1
Cell volume: 5590.45
Cell parameters: 23.8735; 10.3412; 23.7886; 90; 107.843; 90;  

COD ID: 1502489
CIF file Formula: - C38 H32 N4 O19 -
Comments: 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 13(19) (2011) 5290-5293
Space group: C 1 2 1
Cell volume: 4058
Cell parameters: 21.77; 12.9719; 14.4182; 90; 94.7022; 90;  

COD ID: 1502506
CIF file Formula: - C14 H20 Cl N O3 S -
Comments: 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 13(20) (2011) 5556-5559
Space group: C 1 2 1
Cell volume: 1539.85
Cell parameters: 23.5483; 5.9268; 11.3734; 90; 104.05; 90;  

COD ID: 1502524
CIF file Formula: - C15 H18 O4 -
Comments: 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 13(21) (2011) 5748-5750
Space group: C 1 2 1
Cell volume: 2805.97
Cell parameters: 10.00787; 26.3372; 10.8051; 90; 99.8553; 90;  

COD ID: 1502623
CIF file Formula: - C74 H84 Cl2 N6 P2 Ru -
Comments: 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 15(5) (2011) 1178
Space group: C 1 2 1
Cell volume: 15268
Cell parameters: 24.264; 24.798; 26.166; 90; 104.12; 90;  

COD ID: 1502666
CIF file Formula: - C19 H28 B10 O -
Comments: Beer, Michael L.; Lemon, Jennifer; Valliant, John F. Preparation and evaluation of carborane analogues of tamoxifen. Journal of medicinal chemistry 53(22) (2010) 8012-8020
Space group: C 1 2 1
Cell volume: 2178.5
Cell parameters: 24.701; 6.5249; 18.081; 90; 131.621; 90;  

COD ID: 1502715
CIF file Formula: - C54 H70 Cl4 Cu2 N12 O23 -
Comments: 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 114(36) (2010) 11942-11948
Space group: C 1 2 1
Cell volume: 6436
Cell parameters: 35.166; 8.308; 22.479; 90; 101.477; 90;  

COD ID: 1502821
CIF file Formula: - C22 H28 O6 -
Comments: 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 73(2) (2010) 139-142
Space group: C 1 2 1
Cell volume: 2206.9
Cell parameters: 17.066; 6.9212; 19.004; 90; 100.536; 90;  

COD ID: 1502872
CIF file Formula: - C22 H25 N O2 -
Comments: Solomon, Marissa R.; Sivaguru, J.; Jockusch, Steffen; Adam, Waldemar; Turro, Nicholas J. Decoding stereocontrol during the photooxygenation of oxazolidinone-functionalized enecarbamates. Organic letters 12(9) (2010) 2142-2145
Space group: C 1 2 1
Cell volume: 1862
Cell parameters: 20.425; 8.0342; 11.639; 90; 102.867; 90;  

COD ID: 1502883
CIF file Formula: - C20 H19 Cl N2 O2 -
Comments: 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 12(5) (2010) 1140-1143
Space group: C 1 2 1
Cell volume: 1751.71
Cell parameters: 17.1435; 10.1913; 10.6419; 90; 109.586; 90;  

COD ID: 1503158
CIF file Formula: - C22 H35 N3 O6 S Si -
Comments: 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 12(19) (2010) 4244-4247
Space group: C 1 2 1
Cell volume: 5210.4
Cell parameters: 31.131; 7.805; 22.844; 90; 110.163; 90;  

COD ID: 1503178
CIF file Formula: - C18 H19 Br N2 O -
Comments: 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 12(21) (2010) 4720-4723
Space group: C 1 2 1
Cell volume: 1591.39
Cell parameters: 18.7232; 6.9539; 14.145; 90; 120.22; 90;  

COD ID: 1503304
CIF file Formula: - C30 H40 N4 O7 -
Comments: 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 12(23) (2010) 5438-5441
Space group: C 1 2 1
Cell volume: 3211.2
Cell parameters: 23.844; 6.1411; 23.447; 90; 110.722; 90;  

COD ID: 1503390
CIF file Formula: - C25 H29 N O3 -
Comments: Caron, Pierre-Yves; Deslongchamps, Pierre Versatile strategy to access tricycles related to quassinoids and triterpenes. Organic letters 12(3) (2010) 508-511
Space group: C 1 2 1
Cell volume: 2147.8
Cell parameters: 15.457; 9.311; 15.892; 90; 110.108; 90;  

COD ID: 1503464
CIF file Formula: - C16 H16 O5 -
Comments: 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 75(2) (2012) 148-152
Space group: C 1 2 1
Cell volume: 1335
Cell parameters: 17.48; 7.99; 12.93; 90; 132.34; 90;  

COD ID: 1503521
CIF file Formula: - C25 H25 N O2 -
Comments: Trost, Barry M.; Bringley, Dustin A.; Seng, Pamela S. Enantioselective palladium-catalyzed [3 + 2] cycloadditions of trimethylenemethane with nitroalkenes. Organic letters 14(1) (2012) 234-237
Space group: C 1 2 1
Cell volume: 2035
Cell parameters: 27.33; 5.2842; 14.3245; 90; 100.363; 90;  

COD ID: 1503540
CIF file Formula: - C16 H18 O6 -
Comments: 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 14(2) (2012) 513-515
Space group: C 1 2 1
Cell volume: 1450.21
Cell parameters: 16.6297; 8.0075; 10.8932; 90; 91.258; 90;  

COD ID: 1503691
CIF file Formula: - C21 H34 O4 -
Comments: 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 72(6) (2009) 1128-1132
Space group: C 1 2 1
Cell volume: 1971.8
Cell parameters: 17.854; 7.164; 16.135; 90; 107.171; 90;  

COD ID: 1503695
CIF file Formula: - C31 H50 O4 -
Comments: 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 72(8) (2009) 1410-1413
Space group: C 1 2 1
Cell volume: 2781.7
Cell parameters: 12.3341; 7.3877; 30.799; 90; 97.604; 90;  

COD ID: 1503778
CIF file Formula: - C41.25 H50 O13.13 -
Comments: 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 11(4) (2009) 851-854
Space group: C 1 2 1
Cell volume: 8335.4
Cell parameters: 39.015; 9.2033; 23.6697; 90; 101.259; 90;  

COD ID: 1503879
CIF file Formula: - C15 H27 N O2 S2 -
Comments: 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 11(10) (2009) 2193-2196
Space group: C 1 2 1
Cell volume: 1742.9
Cell parameters: 19.68; 6.923; 15.753; 90; 125.7; 90;  

COD ID: 1503880
CIF file Formula: - C22 H52 Br2 P4 Pd2 -
Comments: 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 11(11) (2009) 2245-2248
Space group: C 1 2 1
Cell volume: 3438.4
Cell parameters: 18.1731; 10.7733; 17.5878; 90; 93.105; 90;  

COD ID: 1503901
CIF file Formula: - C26 H25 Br O4 -
Comments: 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 11(12) (2009) 2507-2510
Space group: C 1 2 1
Cell volume: 2249.3
Cell parameters: 21.672; 6.034; 18.445; 90; 111.168; 90;  

COD ID: 1503961
CIF file Formula: - C24 H50 O5 Si4 -
Comments: 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 11(13) (2009) 2744-2747
Space group: C 1 2 1
Cell volume: 3169.6
Cell parameters: 25.1341; 9.5269; 16.8986; 90; 128.434; 90;  

COD ID: 1504084
CIF file Formula: - C17 H24 N2 O4 -
Comments: Duguet, Nicolas; Slawin, Alexandra M. Z.; Smith, Andrew D. An asymmetric hetero-claisen approach to 3-alkyl-3-aryloxindoles. Organic letters 11(17) (2009) 3858-3861
Space group: C 1 2 1
Cell volume: 1763.6
Cell parameters: 23.342; 5.7712; 17.317; 90; 130.887; 90;  

COD ID: 1504096
CIF file Formula: - C23 H34 O4 -
Comments: 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 11(16) (2009) 3674-3676
Space group: C 1 2 1
Cell volume: 2141.1
Cell parameters: 26.323; 6.1374; 13.3377; 90; 96.461; 90;  

COD ID: 1504185
CIF file Formula: - C16 H18 O4 -
Comments: 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 11(20) (2009) 4640-4643
Space group: C 1 2 1
Cell volume: 1349.87
Cell parameters: 18.1933; 7.711; 12.4502; 90; 129.39; 90;  

COD ID: 1504187
CIF file Formula: - C17 H20 O5 -
Comments: 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 11(20) (2009) 4640-4643
Space group: C 1 2 1
Cell volume: 1641.81
Cell parameters: 18.1525; 7.6684; 12.0226; 90; 101.178; 90;  

COD ID: 1504215
CIF file Formula: - C27 H40 O7 Si -
Comments: Krawczuk, Paul J.; Schöne, Niklas; Baran, Phil S. A synthesis of the carbon skeleton of maoecrystal V. Organic letters 11(21) (2009) 4774-4776
Space group: C 1 2 1
Cell volume: 2774.98
Cell parameters: 27.8634; 7.012; 18.3625; 90; 129.332; 90;  

COD ID: 1504217
CIF file Formula: - C21 H27 O7 -
Comments: Krawczuk, Paul J.; Schöne, Niklas; Baran, Phil S. A synthesis of the carbon skeleton of maoecrystal V. Organic letters 11(21) (2009) 4774-4776
Space group: C 1 2 1
Cell volume: 3922.31
Cell parameters: 30.4299; 7.0493; 19.6268; 90; 111.309; 90;  

COD ID: 1504264
CIF file Formula: - C21 H20 Br N O4 -
Comments: Hong, Bor-Cherng; Jan, Rei-Hau; Tsai, Chih-Wei; Nimje, Roshan Y.; Liao, Ju-Hsiou; Lee, Gene-Hsiang Organocatalytic enantioselective cascade Michael-Michael-Wittig reactions of phosphorus ylides: one-pot synthesis of the all-cis trisubstituted cyclohexenecarboxylates via the [1 + 2 + 3] annulation. Organic letters 11(22) (2009) 5246-5249
Space group: C 1 2 1
Cell volume: 3994.9
Cell parameters: 17.9311; 10.112; 22.4591; 90; 101.184; 90;  

COD ID: 1504341
CIF file Formula: - C21 H34 N2 O3 -
Comments: Gomtsyan, Arthur; Bayburt, Erol K.; Schmidt, Robert G.; Surowy, Carol S.; Honore, Prisca; Marsh, Kennan C.; Hannick, Steven M.; McDonald, Heath A.; Wetter, Jill M.; Sullivan, James P.; Jarvis, Michael F.; Faltynek, Connie R.; Lee, Chih-Hung Identification of (R)-1-(5-tert-butyl-2,3-dihydro-1H-inden-1-yl)-3-(1H-indazol-4-yl)urea (ABT-102) as a potent TRPV1 antagonist for pain management. Journal of medicinal chemistry 51(3) (2008) 392-395
Space group: C 1 2 1
Cell volume: 2173.2
Cell parameters: 19.155; 5.871; 19.432; 90; 96.031; 90;  

COD ID: 1504444
CIF file Formula: - C33.5 H54 O7 -
Comments: Chen, Jian-Jun; Fei, Dong-Qing; Chen, Sheng-Gao; Gao, Kun Antimicrobial triterpenoids from Vladimiria muliensis. Journal of natural products 71(4) (2008) 547-550
Space group: C 1 2 1
Cell volume: 3268
Cell parameters: 32.341; 8.429; 12.051; 90; 95.82; 90;  

COD ID: 1504471
CIF file Formula: - C19 H26 O6 -
Comments: Burns, Aaron C.; Forsyth, Craig J. Intramolecular Diels-Alder/Tsuji allylation assembly of the functionalized trans-decalin of salvinorin A. Organic letters 10(1) (2008) 97-100
Space group: C 1 2 1
Cell volume: 1855.8
Cell parameters: 13.2953; 9.3972; 15.81; 90; 110.029; 90;  

COD ID: 1504628
CIF file Formula: - C28 H54 O5 Si2 -
Comments: Zhan, Weiqiang; Jiang, Yi; Brodie, Peggy J.; Kingston, David G. I.; Liotta, Dennis C.; Snyder, James P. Design and synthesis of C6-C8 bridged epothilone A. Organic letters 10(8) (2008) 1565-1568
Space group: C 1 2 1
Cell volume: 6530.7
Cell parameters: 36.7236; 7.3663; 25.1062; 90; 105.935; 90;  

COD ID: 1504641
CIF file Formula: - C17 H23 N O S -
Comments: Maji, Modhu Sudan; Fröhlich, Roland; Studer, Armido Desymmetrization of metallated cyclohexadienes with chiral N-tert-butanesulfinyl imines. Organic letters 10(9) (2008) 1847-1850
Space group: C 1 2 1
Cell volume: 1588.15
Cell parameters: 20.512; 5.5194; 14.7817; 90; 108.377; 90;  

COD ID: 1504733
CIF file Formula: - C17.25 H20 Br N4 O8.25 -
Comments: Shibata, Yu; Noguchi, Keiichi; Hirano, Masao; Tanaka, Ken Rhodium-catalyzed highly enantio- and diastereoselective cotrimerization of alkenes and dialkyl acetylenedicarboxylates leading to furylcyclopropanes. Organic letters 10(13) (2008) 2825-2828
Space group: C 1 2 1
Cell volume: 4208.43
Cell parameters: 32.6745; 6.89073; 18.7222; 90; 93.278; 90;  

COD ID: 1504737
CIF file Formula: - C10 H9.6 Cl4 O4 -
Comments: Khan, Faiz Ahmed; Sudheer, Ch A chiral pool approach to the synthesis of optically active tetrahalo norbornyl building blocks. Organic letters 10(14) (2008) 3029-3032
Space group: C 1 2 1
Cell volume: 3412.5
Cell parameters: 29.003; 8.7758; 13.4454; 90; 94.309; 90;  

COD ID: 1504745
CIF file Formula: - C43 H54 Br2 N2 O11 P2 S2 -
Comments: Nishida, Goushi; Ogaki, Shuichiro; Yusa, Yukinori; Yokozawa, Tohru; Noguchi, Keiichi; Tanaka, Ken Practical enantioselective synthesis of axially chiral biaryl diphosphonates and dicarboxylates by cationic rhodium(I)/Segphos-catalyzed double [2 + 2 + 2] cycloaddition. Organic letters 10(13) (2008) 2849-2852
Space group: C 1 2 1
Cell volume: 2325.33
Cell parameters: 17.2078; 11.5303; 12.0049; 90; 102.513; 90;  

COD ID: 1504792
CIF file Formula: - C26 H27 Br O4 -
Comments: Yamashita, Shuji; Iso, Kentaro; Hirama, Masahiro A concise synthesis of the pentacyclic framework of cortistatins. Organic letters 10(16) (2008) 3413-3415
Space group: C 1 2 1
Cell volume: 2439
Cell parameters: 21.235; 8.271; 13.904; 90; 92.777; 90;  

COD ID: 1504875
CIF file Formula: - C15 H22 O3 -
Comments: Austin, Kerrie A. B.; Banwell, Martin G.; Willis, Anthony C. A formal total synthesis of platencin. Organic letters 10(20) (2008) 4465-4468
Space group: C 1 2 1
Cell volume: 1355.57
Cell parameters: 20.1825; 8.7994; 7.8934; 90; 104.758; 90;  

COD ID: 1504884
CIF file Formula: - C15 H18 Cl2 O -
Comments: Darses, Benjamin; Milet, Anne; Philouze, Christian; Greene, Andrew E.; Poisson, Jean-François Ynol ethers from dichloroenol ethers: mechanistic elucidation through 35Cl labeling. Organic letters 10(20) (2008) 4445-4447
Space group: C 1 2 1
Cell volume: 1486.4
Cell parameters: 18.507; 7.3736; 10.893; 90; 90.553; 90;  

COD ID: 1504901
CIF file Formula: - C16 H22 O5 -
Comments: Bridgwood, Katy L.; Tzschucke, C. Christoph; O'Brien, Matthew; Wittrock, Sven; Goodman, Jonathan M.; Davies, John E.; Logan, Angus W. J.; Hüttl, Matthias R M; Ley, Steven V. Enantiopure 2-substituted glyceraldehyde derivatives by aza-Claisen rearrangement or C-alkylation of enamines. Organic letters 10(20) (2008) 4537-4540
Space group: C 1 2 1
Cell volume: 1610.11
Cell parameters: 22.3552; 6.7979; 11.9364; 90; 117.424; 90;  

COD ID: 1505283
CIF file Formula: - C22 H26 N2 O7 -
Comments: Watanabe, Hideaki; Takano, Masashi; Umino, Akinori; Ito, Toshiya; Ishikawa, Hiroyuki; Nakada, Masahisa Enantioselective total synthesis of (-)-erinacine B. Organic letters 9(2) (2007) 359-362
Space group: C 1 2 1
Cell volume: 2049.9
Cell parameters: 23.8; 6.428; 15.69; 90; 121.35; 90;  

COD ID: 1505326
CIF file Formula: - C33 H36 O8 -
Comments: Yang, Sheng-Ping; Gao, Zhao-Bing; Wang, Fang-Dao; Liao, Shang-Gao; Chen, Hua-Dong; Zhang, Chuan-Rui; Hu, Guo-Yuan; Yue, Jian-Min Chlorahololides A and B, two potent and selective blockers of the potassium channel isolated from Chloranthus holostegius. Organic letters 9(5) (2007) 903-906
Space group: C 1 2 1
Cell volume: 2923
Cell parameters: 17.216; 11.078; 16.173; 90; 108.63; 90;  

COD ID: 1505336
CIF file Formula: - C31 H24 Cl2 N2 O2 -
Comments: Wada, Azusa; Noguchi, Keiichi; Hirano, Masao; Tanaka, Ken Enantioselective synthesis of C2 -symmetric spirobipyridine ligands through cationic Rh(I)/modified-BINAP- catalyzed double [2 + 2 + 2] cycloaddition. Organic letters 9(7) (2007) 1295-1298
Space group: C 1 2 1
Cell volume: 1198.3
Cell parameters: 21.612; 5.5038; 11.8718; 90; 121.939; 90;  

COD ID: 1505343
CIF file Formula: - C14 H22 O4 -
Comments: Chanu, Angéline; Safir, Imad; Basak, Ramkrishna; Chiaroni, Angèle; Arseniyadis, Siméon Enantioselective total synthesis of 1-epi-pathylactone A. Organic letters 9(7) (2007) 1351-1354
Space group: C 1 2 1
Cell volume: 1346.2
Cell parameters: 13.042; 13.746; 7.51; 90; 90.74; 90;  

COD ID: 1505432
CIF file Formula: - C20 H22 O6 -
Comments: Takikawa, Hiroshi; Suzuki, Keisuke Modified chiral triazolium salts for enantioselective benzoin cyclization of enolizable keto-aldehydes: synthesis of (+)-sappanone B. Organic letters 9(14) (2007) 2713-2716
Space group: C 1 2 1
Cell volume: 1748.8
Cell parameters: 26.729; 6.1676; 11.6348; 90; 114.247; 90;  

COD ID: 1505501
CIF file Formula: - C15 H27 I2 N2 O -
Comments: Pham, Van Cuong; Jossang, Akino; Chiaroni, Angèle; Sévenet, Thierry; Nguyen, Van Hung; Bodo, Bernard Solution and crystal conformations of myrionine, a new 8beta-alkyl-cis-decahydroquinoline of Myrioneuron nutans. Organic letters 9(18) (2007) 3531-3534
Space group: C 1 2 1
Cell volume: 1933
Cell parameters: 19.778; 8.141; 12.696; 90; 109; 90;  

COD ID: 1505506
CIF file Formula: - C26 H29 N O5 -
Comments: Gilley, Cynthia B.; Buller, Matthew J.; Kobayashi, Yoshihisa New entry to convertible isocyanides for the Ugi reaction and its application to the stereocontrolled formal total synthesis of the proteasome inhibitor omuralide. Organic letters 9(18) (2007) 3631-3634
Space group: C 1 2 1
Cell volume: 2352.6
Cell parameters: 35.16; 6.0221; 11.589; 90; 106.518; 90;  

COD ID: 1505545
CIF file Formula: - C13 H14 Br N O3 -
Comments: Ko, Changhong; Hsung, Richard P.; Al-Rashid, Ziyad F; Feltenberger, John B.; Lu, Ting; Yang, Jin-Haek; Wei, Yonggang; Zificsak, Craig A. A stereoselective intramolecular halo-etherification of chiral enamides in the synthesis of halogenated cyclic ethers. Organic letters 9(22) (2007) 4459-4462
Space group: C 1 2 1
Cell volume: 1290.7
Cell parameters: 20.682; 5.9165; 11.67; 90; 115.333; 90;  

COD ID: 1505580
CIF file Formula: - C80 H134 N4 O13 -
Comments: Zhang, Yu-Mei; Tan, Ning-Hua; Lu, Yang; Chang, Ying; Jia, Rui-Rui Chamobtusin A, a novel skeleton diterpenoid alkaloid from Chamaecyparis obtusa cv. tetragon. Organic letters 9(22) (2007) 4579-4581
Space group: C 1 2 1
Cell volume: 3989
Cell parameters: 23.563; 8.728; 19.397; 90; 90.48; 90;  

COD ID: 1505612
CIF file Formula: - C23 H28 O11 S -
Comments: Porto, Silvia; Seco, José Manuel; Ortiz, Aurelio; Quiñoá, Emilio; Riguera, Ricardo Chiral thiols: the assignment of their absolute configuration by 1H NMR. Organic letters 9(24) (2007) 5015-5018
Space group: C 1 2 1
Cell volume: 4924
Cell parameters: 27.301; 9.969; 18.683; 90; 104.455; 90;  

COD ID: 1505621
CIF file Formula: - C20 H22 O4 -
Comments: Hayashi, Naoto; Yoshikawa, Takahiro; Ohnuma, Takahiro; Higuchi, Hiroyuki; Sako, Katsuya; Uekusa, Hidehiro Synthesis, structure, and properties of benzoquinone dimer and trimers bearing t-Bu substituents. Organic letters 9(26) (2007) 5417-5420
Space group: C 1 2 1
Cell volume: 873.1
Cell parameters: 10.392; 6.462; 13.048; 90; 94.84; 90;  

COD ID: 1505802
CIF file Formula: - C22 H22 O3 -
Comments: Hölscher, Dirk; Reichert, Matthias; Görls, Hilmar; Ohlenschläger, Oliver; Bringmann, Gerhard; Schneider, Bernd Monolaterol, the first configurationally assigned phenylphenalenone derivative with a stereogenic center at C-9, from Monochoria elata. Journal of natural products 69(11) (2006) 1614-1617
Space group: C 1 2 1
Cell volume: 1775.63
Cell parameters: 24.2636; 8.0884; 9.3582; 90; 104.802; 90;  

COD ID: 1505844
CIF file Formula: - C6 H11 Br O -
Comments: Ros, Abel; Magriz, Antonio; Dietrich, Hansjörg; Fernández, Rosario; Alvarez, Eleuterio; Lassaletta, José M Enantioselective synthesis of vicinal halohydrins via dynamic kinetic resolution. Organic letters 8(1) (2006) 127-130
Space group: C 1 2 1
Cell volume: 2148.6
Cell parameters: 23.7316; 6.1829; 15.0644; 90; 103.579; 90;  

COD ID: 1505865
CIF file Formula: - C30 H31 N2 O6 -
Comments: Mazal, Ctibor; Skarka, Ondrej; Kaleta, Jirí; Michl, Josef cis-endo-Bicyclo[1.1.1]pentane-1,2,3,4- tetracarboxylic acid and its derivatives. Organic letters 8(4) (2006) 749-752
Space group: C 1 2 1
Cell volume: 2665.7
Cell parameters: 25.89; 9.1958; 11.305; 90; 97.94; 90;  

COD ID: 1505904
CIF file Formula: - C43 H60 Br2 N4 O7.5 -
Comments: Khatri, Vijay K.; Upreti, Shailesh; Pandey, Pramod S. Novel bile acid-based cyclic bisimidazolium receptors for anion recognition. Organic letters 8(9) (2006) 1755-1758
Space group: C 1 2 1
Cell volume: 4668
Cell parameters: 27.172; 8.5342; 23.688; 90; 121.809; 90;  

COD ID: 1505906
CIF file Formula: - C22 H19 Br N2 O2 S -
Comments: Jia, Yi-Xia; Xie, Jian-Hua; Duan, Hai-Feng; Wang, Li-Xin; Zhou, Qi-Lin Asymmetric Friedel-Crafts addition of indoles to N-sulfonyl aldimines: a simple approach to optically active 3-indolyl-methanamine derivatives. Organic letters 8(8) (2006) 1621-1624
Space group: C 1 2 1
Cell volume: 4185
Cell parameters: 18.443; 8.521; 27.694; 90; 105.917; 90;  

COD ID: 1505984
CIF file Formula: - C27 H29 N O -
Comments: Smith, 3rd, Amos B; Kürti, Laszló; Davulcu, Akin H. A new modular indole synthesis. Construction of the highly strained CDEF parent tetracycle of nodulisporic acids A and B. Organic letters 8(10) (2006) 2167-2170
Space group: C 1 2 1
Cell volume: 2040.5
Cell parameters: 18.451; 8.185; 13.7757; 90; 101.249; 90;  

COD ID: 1506054
CIF file Formula: - C23 H38 N2 O -
Comments: Pelegrí, Adela Sanchez; Elsegood, Mark R. J.; McKee, Vickie; Weaver, George W. Unexpected ring expansion of an enantiopure imidazoline carbene ligand. Organic letters 8(14) (2006) 3049-3051
Space group: C 1 2 1
Cell volume: 1051.5
Cell parameters: 13.85; 6.406; 13.724; 90; 120.28; 90;  

COD ID: 1506064
CIF file Formula: - C23.5 H31 Cl N2 O1.5 -
Comments: Iden, Hassan S.; Lubell, William D. 1,4-Diazepinone and pyrrolodiazepinone syntheses via homoallylic ketones from cascade addition of vinyl Grignard reagent to alpha-aminoacyl-beta-amino esters. Organic letters 8(16) (2006) 3425-3428
Space group: C 1 2 1
Cell volume: 2251.3
Cell parameters: 24.254; 6.6426; 17.061; 90; 125.009; 90;  

COD ID: 1506084
CIF file Formula: - C25 H34 N2 O5 S -
Comments: Garner, Philip; Kaniskan, H. Umit; Hu, Jieyu; Youngs, Wiley J.; Panzner, Matthew Asymmetric multicomponent [C+NC+CC] synthesis of highly functionalized pyrrolidines catalyzed by silver(I). Organic letters 8(17) (2006) 3647-3650
Space group: C 1 2 1
Cell volume: 2375.5
Cell parameters: 25.555; 7.2399; 15.3012; 90; 122.954; 90;  

COD ID: 1506137
CIF file Formula: - C25 H23 N3 O5 -
Comments: Reddy, B. V. Subba; Reddy, Leleti Rajender; Corey, E. J. Novel acetoxylation and C-C coupling reactions at unactivated positions in alpha-amino acid derivatives. Organic letters 8(15) (2006) 3391-3394
Space group: C 1 2 1
Cell volume: 4555.5
Cell parameters: 30.159; 8.8874; 20.568; 90; 124.276; 90;  

COD ID: 1506139
CIF file Formula: - C15 H18 N2 O4 -
Comments: Magnus, Philip; Padilla, Angela I. Proposed biogenetic origin of secu'amamine A from allosecurinine: a model study to support the intermediacy of the putative aziridinium ion. Organic letters 8(16) (2006) 3569-3571
Space group: C 1 2 1
Cell volume: 2927.9
Cell parameters: 12.0635; 9.7402; 25.188; 90; 98.39; 90;  

COD ID: 1506314
CIF file Formula: - C30 H34 Cl N3 O6 -
Comments: Mizoguchi, Jun-ichi; Kawanami, Yuko; Wada, Takehiko; Kodama, Kazuya; Anzai, Kinsei; Yanagi, Toshiharu; Inoue, Yoshihisa Enantiodifferentiating photocyclodimerization of 2-anthracenecarboxylic acid using a chiral N-(2-hydroxymethyl-4- pyrrolidinyl)benzamide template. Organic letters 8(26) (2006) 6051-6054
Space group: C 1 2 1
Cell volume: 2897.91
Cell parameters: 29.6799; 6.1328; 16.0196; 90; 96.368; 90;  

COD ID: 1506539
CIF file Formula: - C14 H26 O6 S2 -
Comments: Ward, Dale E.; Jheengut, Vishal; Akinnusi, Olukayode T. Enantioselective direct intermolecular aldol reactions with enantiotopic group selectivity and dynamic kinetic resolution. Organic letters 7(6) (2005) 1181-1184
Space group: C 1 2 1
Cell volume: 1634.35
Cell parameters: 20.556; 5.32; 15.025; 90; 95.915; 90;  

COD ID: 1506620
CIF file Formula: - C15 H23 N O -
Comments: Bilke, Julia Luzia; Dzuganova, Monika; Fröhlich, Roland; Würthwein, Ernst-Ulrich Diastereoselective one-step synthesis of functionalized cis-aziridinyl alcohols from oxiranyl carbaldimines. Organic letters 7(15) (2005) 3267-3270
Space group: C 1 2 1
Cell volume: 1434.3
Cell parameters: 16.412; 5.944; 14.762; 90; 95.14; 90;  

COD ID: 1506720
CIF file Formula: - C13 H14 Br N O4 -
Comments: Wang, Jian; Li, Hao; Duan, Wenhu; Zu, Liansuo; Wang, Wei Organocatalytic asymmetric Michael addition of 2,4-pentandione to nitroolefins. Organic letters 7(21) (2005) 4713-4716
Space group: C 1 2 1
Cell volume: 1425.12
Cell parameters: 16.5687; 5.235; 16.4498; 90; 92.787; 90;  

COD ID: 1506725
CIF file Formula: - C23 H24 O2 Sn -
Comments: Dimopoulos, Paschalis; George, Jonathan; Tocher, Derek A.; Manaviazar, Soraya; Hale, Karl J. Mechanistic studies on the O-directed free-radical hydrostannation of disubstituted acetylenes with Ph3SnH and Et3B and on the iodination of allylically oxygenated alpha-triphenylstannylalkenes. Organic letters 7(24) (2005) 5377-5380
Space group: C 1 2 1
Cell volume: 8167.3
Cell parameters: 36.529; 11.7506; 26.095; 90; 133.184; 90;  

COD ID: 1506922
CIF file Formula: - C15 H18 Cl F2 N O -
Comments: Nowak, Ireneusz; Cannon, John F.; Robins, Morris J. Synthesis and properties of gem-(difluorocyclopropyl)amine derivatives of bicyclo[n.1.0]alkanes. Organic letters 6(25) (2004) 4767-4770
Space group: C 1 2 1
Cell volume: 1402.09
Cell parameters: 14.7787; 11.8125; 8.9824; 90; 116.602; 90;  

COD ID: 1506943
CIF file Formula: - C18 H22 N O6 V -
Comments: Chen, Chien-Tien; Lin, Jin-Sheng; Kuo, Jen-Huang; Weng, Shiue-Shien; Cuo, Ting-Shen; Lin, Yi-Wen; Cheng, Chien-Chung; Huang, Yan-Chen; Yu, Jen-Kan; Chou, Pi-Tai Site-selective DNA photocleavage involving unusual photoinitiated tautomerization of chiral tridentate vanadyl(V) complexes derived from N-salicylidene alpha-amino acids. Organic letters 6(24) (2004) 4471-4474
Space group: C 1 2 1
Cell volume: 1946.46
Cell parameters: 34.174; 6.545; 8.939; 90; 103.211; 90;  

COD ID: 1506957
CIF file Formula: - C30 H41 N3 O8 -
Comments: Ray, Sudipta; Haldar, Debasish; Drew, Michael G. B.; Banerjee, Arindam A new motif in the formation of peptide nanotubes: the crystallographic signature. Organic letters 6(24) (2004) 4463-4465
Space group: C 1 2 1
Cell volume: 3181
Cell parameters: 24.287; 5.089; 26.519; 90; 103.94; 90;  

COD ID: 1506958
CIF file Formula: - C29 H39 N3 O8 -
Comments: Ray, Sudipta; Haldar, Debasish; Drew, Michael G. B.; Banerjee, Arindam A new motif in the formation of peptide nanotubes: the crystallographic signature. Organic letters 6(24) (2004) 4463-4465
Space group: C 1 2 1
Cell volume: 3114
Cell parameters: 24.3; 5.062; 25.97; 90; 102.882; 90;  

COD ID: 1506962
CIF file Formula: - C11 H18 O3 S2 -
Comments: Overman, Larry E.; Velthuisen, Emile J. Stereocontrolled construction of either stereoisomer of 12-oxatricyclo[6.3.1.0(2,7)]dodecanes using Prins-pinacol reactions. Organic letters 6(21) (2004) 3853-3856
Space group: C 1 2 1
Cell volume: 1258.11
Cell parameters: 14.0471; 7.9277; 11.5877; 90; 102.849; 90;  

COD ID: 1506996
CIF file Formula: - C42 H40 Cl2 Rh2 -
Comments: Shintani, Ryo; Ueyama, Kazuhito; Yamada, Ichiro; Hayashi, Tamio Chiral norbornadienes as efficient ligands for the rhodium-catalyzed asymmetric 1,4-addition of arylboronic acids to fumaric and maleic compounds. Organic letters 6(19) (2004) 3425-3427
Space group: C 1 2 1
Cell volume: 1902
Cell parameters: 28.551; 5.731; 12.165; 90; 107.15; 90;  

COD ID: 1507025
CIF file Formula: - C42 H27 F6 N3 P S3 -
Comments: Okamoto, Toshihiro; Kuratsu, Masato; Kozaki, Masatoshi; Hirotsu, Ken; Ichimura, Akio; Matsushita, Toshio; Okada, Keiji Remarkable structure deformation in phenothiazine trimer radical cation. Organic letters 6(20) (2004) 3493-3496
Space group: C 1 2 1
Cell volume: 3865
Cell parameters: 27.6; 9.129; 15.39; 90; 94.647; 90;  

COD ID: 1507064
CIF file Formula: - C15 H23 N O3 Si -
Comments: Suga, Seiji; Kageyama, Yasuhisa; Babu, Govindarajulu; Itami, Kenichiro; Yoshida, Jun-ichi Cationic carbohydroxylation of alkenes and alkynes using the cation pool method. Organic letters 6(16) (2004) 2709-2711
Space group: C 1 2 1
Cell volume: 1676.2
Cell parameters: 10.733; 6.3666; 24.617; 90; 94.813; 90;  

COD ID: 1507194
CIF file Formula: - C21 H28 O4 -
Comments: Castillo, Rafael R.; Aquino, Maurizio; Gandara, Zoila; Safir, Imad; Elkhayat, Zobida; Retailleau, Pascal; Arseniyadis, Siméon Diverging Pathways to Topologically Complex Polycyclic Bis-acetals and Their Ring System Interchange. Organic letters 14(6) (2012) 1628-1631
Space group: C 1 2 1
Cell volume: 1901
Cell parameters: 18.037; 7.825; 13.631; 90; 98.78; 90;  

COD ID: 1507325
CIF file Formula: - C10 H16 O3 -
Comments: Su, Qibin; Beeler, Aaron B.; Lobkovsky, Emil; Porco, Jr, John A; Panek, James S. Stereochemical diversity through cyclodimerization: synthesis of polyketide-like macrodiolides. Organic letters 5(12) (2003) 2149-2152
Space group: C 1 2 1
Cell volume: 1050.9
Cell parameters: 18.327; 5.478; 13.272; 90; 127.937; 90;  

COD ID: 1507371
CIF file Formula: - C14 H25 N O4 Si -
Comments: Alonso-Cruz, Carmen R; Kennedy, Alan R.; Rodríguez, María S; Suárez, Ernesto Fragmentation of carbohydrate anomeric alkoxyl radicals. A new synthesis of chiral beta-iodo azides, vinyl azides, and 2H-azirines. Organic letters 5(20) (2003) 3729-3732
Space group: C 1 2 1
Cell volume: 1660.74
Cell parameters: 16.4478; 6.2864; 16.1368; 90; 95.529; 90;  

COD ID: 1507394
CIF file Formula: - C14 H16 O5 S -
Comments: Díez, David; Benéitez, M Templo; Marcos, Isidro S.; Garrido, N. M.; Basabe, P.; Sanz, F.; Broughton, Howard B.; Urones, Julio G. Chemistry of epoxysulfones: straightforward synthesis of versatile chiral building blocks. Organic letters 5(23) (2003) 4361-4364
Space group: C 1 2 1
Cell volume: 1420.5
Cell parameters: 15.814; 10.55; 10.919; 90; 128.76; 90;  

COD ID: 1507489
CIF file Formula: - C30 H35 N O12 -
Comments: Yang, Zhixiang; Shannon, Dean; Truong, Vouy-Linh; Deslongchamps, Pierre Studies directed toward asymmetric synthesis of cardioactive steroids via anionic polycyclization. Organic letters 4(26) (2002) 4693-4696
Space group: C 1 2 1
Cell volume: 2855.1
Cell parameters: 28.625; 6.7023; 17.446; 90; 121.459; 90;  

COD ID: 1507547
CIF file Formula: - C5 H7 N O3 -
Comments: Cheng, Jianjun; Ziller, Joseph W.; Deming, Timothy J. Synthesis of Optically Active β-Amino AcidN-Carboxyanhydrides Organic Letters 2(13) (2000) 1943
Space group: C 1 2 1
Cell volume: 1169.48
Cell parameters: 18.672; 9.6069; 6.5761; 90; 97.519; 90;  

COD ID: 1507599
CIF file Formula: - C18 H14 N2 O -
Comments: Prakash, Muthuraj; Kesavan, Venkitasamy Highly Enantioselective Synthesis of 2,3-Dihydroquinazolinones through Intramolecular Amidation of Imines. Organic letters 14(7) (2012) 1896-1899
Space group: C 1 2 1
Cell volume: 2803.5
Cell parameters: 20.7827; 11.5084; 11.8588; 90; 98.727; 90;  

COD ID: 1507662
CIF file Formula: - C43 H52 N4 O5 -
Comments: Lim, Siew-Huah; Low, Yun-Yee; Tan, Shin-Jowl; Lim, Kuan-Hon; Thomas, Noel F.; Kam, Toh-Seok Perhentidines a-C: macroline-macroline bisindoles from alstonia and the absolute configuration of perhentinine and macralstonine. Journal of natural products 75(5) (2012) 942-950
Space group: C 1 2 1
Cell volume: 3632.9
Cell parameters: 30.173; 6.7184; 18.895; 90; 108.475; 90;  

COD ID: 1507699
CIF file Formula: - C19 H20 Br N O2 -
Comments: Xu, Qing-Long; Dai, Li-Xin; You, Shu-Li Enantioselective synthesis of tetrahydroisoquinolines via iridium-catalyzed intramolecular Friedel-Crafts-type allylic alkylation of phenols. Organic letters 14(10) (2012) 2579-2581
Space group: C 1 2 1
Cell volume: 1679.6
Cell parameters: 27.921; 7.0957; 8.9295; 90; 108.305; 90;  

COD ID: 1507893
CIF file Formula: - C28 H19 N O -
Comments: Tnay, Ya Lin; Chen, Cheng; Chua, Yi Yuan; Zhang, Line; Chiba, Shunsuke Copper-catalyzed aerobic spirocyclization of biaryl-N-H-imines via 1,4-aminooxygenation of benzene rings. Organic letters 14(13) (2012) 3550-3553
Space group: C 1 2 1
Cell volume: 1984.62
Cell parameters: 14.8671; 11.2207; 12.8259; 90; 111.942; 90;  

COD ID: 1508014
CIF file Formula: - Cs2 Ga2 S7 Sb2 -
Comments: Ding, Nan; Kanatzidis, Mercouri G. Selective incarceration of caesium ions by Venus flytrap action of a flexible framework sulfide. Nature chemistry 2(3) (2010) 187-191
Space group: C 1 2 1
Cell volume: 1641.1
Cell parameters: 15.591; 9.1815; 12.575; 90; 114.26; 90;  

COD ID: 1508146
CIF file Formula: - C71 H74.5 N5.5 O20 -
Comments: Ohta, Eisuke; Sato, Hiroyasu; Ando, Shinji; Kosaka, Atsuko; Fukushima, Takanori; Hashizume, Daisuke; Yamasaki, Mikio; Hasegawa, Kimiko; Muraoka, Azusa; Ushiyama, Hiroshi; Yamashita, Koichi; Aida, Takuzo Redox-responsive molecular helices with highly condensed π-clouds. Nature chemistry 3(1) (2011) 68-73
Space group: C 1 2 1
Cell volume: 6615.1
Cell parameters: 26.465; 13.3084; 20.9193; 90; 116.126; 90;  

COD ID: 1508152
CIF file Formula: - C23.75 H44.5 Cl4.5 Mo N P2 -
Comments: Arashiba, Kazuya; Miyake, Yoshihiro; Nishibayashi, Yoshiaki A molybdenum complex bearing PNP-type pincer ligands leads to the catalytic reduction of dinitrogen into ammonia. Nature chemistry 3(2) (2011) 120-125
Space group: C 1 2 1
Cell volume: 6855.1
Cell parameters: 28.6387; 14.9963; 19.6011; 90; 125.48; 90;  

COD ID: 1508253
CIF file Formula: - C18 H27 F2 N O5 -
Comments: Yu, Wenquan; Gill, Tina; Wang, Lijuan; Du, Yanming; Ye, Hong; Qu, Xiaowang; Guo, Ju-Tao; Cuconati, Andrea; Zhao, Kang; Block, Timothy M.; Xu, Xiaodong; Chang, Jinhong Design, Synthesis, and Biological Evaluation of N-Alkylated Deoxynojirimycin (DNJ) Derivatives for the Treatment of Dengue Virus Infection. Journal of medicinal chemistry 55(13) (2012) 6061-6075
Space group: C 1 2 1
Cell volume: 1876.09
Cell parameters: 13.6384; 7.1514; 19.5985; 90; 101.048; 90;  

COD ID: 1508307
CIF file Formula: - C21 H18 O4 S2 -
Comments: Orue, Ane; Reyes, Efraím; Vicario, Jose L.; Carrillo, Luisa; Uria, Uxue Enantio- and diastereoselective synthesis of substituted tetrahydro-1H-isochromanes through a dynamic kinetic resolution proceeding under dienamine catalysis. Organic letters 14(14) (2012) 3740-3743
Space group: C 1 2 1
Cell volume: 3712.97
Cell parameters: 38.5256; 5.8558; 17.9538; 90; 113.551; 90;  

COD ID: 1508312
CIF file Formula: - C34.5 H29 Cl3 N1.5 O6 -
Comments: Zhong, Fangrui; Chen, Guo-Ying; Han, Xiaoyu; Yao, Weijun; Lu, Yixin Asymmetric construction of functionalized bicyclic imides via [3 + 2] annulation of MBH carbonates catalyzed by dipeptide-based phosphines. Organic letters 14(14) (2012) 3764-3767
Space group: C 1 2 1
Cell volume: 6652.3
Cell parameters: 28.605; 16.6826; 15.5685; 90; 116.439; 90;  

COD ID: 1508692
CIF file Formula: - C19 H24 Br N O4 -
Comments: Mukaeda, Yuki; Kato, Takuya; Hosokawa, Seijiro Syn-selective Kobayashi aldol reaction using the E,E-vinylketene silyl N,O-acetal. Organic letters 14(20) (2012) 5298-5301
Space group: C 1 2 1
Cell volume: 1878.7
Cell parameters: 25.422; 6.1383; 12.182; 90; 98.781; 90;  

COD ID: 1508693
CIF file Formula: - C19 H24 N2 O6 -
Comments: Mukaeda, Yuki; Kato, Takuya; Hosokawa, Seijiro Syn-selective Kobayashi aldol reaction using the E,E-vinylketene silyl N,O-acetal. Organic letters 14(20) (2012) 5298-5301
Space group: C 1 2 1
Cell volume: 1888.05
Cell parameters: 24.942; 6.13836; 12.4356; 90; 97.4055; 90;  

COD ID: 1508755
CIF file Formula: - C26 H22 Cl N O3 -
Comments: Cassani, Carlo; Melchiorre, Paolo Direct catalytic enantioselective vinylogous aldol reaction of α-branched enals with isatins. Organic letters 14(21) (2012) 5590-5593
Space group: C 1 2 1
Cell volume: 2092.1
Cell parameters: 26.891; 6.5139; 13.524; 90; 117.976; 90;  

COD ID: 1508759
CIF file Formula: - C43 H44 N O5 S -
Comments: Miyauchi, Yuta; Noguchi, Keiichi; Tanaka, Ken Rhodium-catalyzed one-pot intermolecular [2 + 2 + 2] trimerization/asymmetric intramolecular [4 + 2] cycloaddition of two aryl ethynyl ethers and 5-alkynals. Organic letters 14(23) (2012) 5856-5859
Space group: C 1 2 1
Cell volume: 3681.3
Cell parameters: 20.5752; 8.5637; 20.8927; 90; 90.195; 90;  

COD ID: 1508764
CIF file Formula: - C34 H45 N O7 Si -
Comments: Harada, Masaya; Asaba, Ken Nunettsu; Iwai, Masumi; Kogure, Noriyuki; Kitajima, Mariko; Takayama, Hiromitsu Asymmetric total synthesis of an iboga-type indole alkaloid, voacangalactone, newly isolated from Voacanga africana. Organic letters 14(22) (2012) 5800-5803
Space group: C 1 2 1
Cell volume: 3387
Cell parameters: 25.936; 11.367; 12.416; 90; 112.285; 90;  

COD ID: 1508864
CIF file Formula: - C25 H25 N3 O3 -
Comments: Hong, Bor-Cherng; Liao, Wei-Kai; Dange, Nitin S.; Liao, Ju-Hsiou One-pot organocatalytic enantioselective domino double-Michael reaction and pictet-spengler-lactamization reaction. A facile entry to the "inside yohimbane" system with five contiguous stereogenic centers. Organic letters 15(3) (2013) 468-471
Space group: C 1 2 1
Cell volume: 2088.8
Cell parameters: 21.033; 9.9868; 10.2026; 90; 102.928; 90;  

COD ID: 1508931
CIF file Formula: - C21 H13 Cl4 N2 O3 -
Comments: Alvarez-Mico, Xavier; Jensen, Paul R.; Fenical, William; Hughes, Chambers C. Chlorizidine, a Cytotoxic 5H-Pyrrolo[2,1-a]isoindol-5-one-Containing Alkaloid from a Marine Streptomyces sp. Organic letters 15(5) (2013) 988-991
Space group: C 1 2 1
Cell volume: 2054.25
Cell parameters: 26.5331; 8.0048; 9.7571; 90; 97.575; 90;  

COD ID: 1509006
CIF file Formula: - Ag0.6 Ga3 Te4.75 -
Comments: Zabel, M.; Panzer, P.; Range, K.J. Hochdrucksynthese und Kristallstruktur von Ag2 Ga6 Te10 Journal of the Less-Common Metals 106 (1985) 305-314
Space group: C 1 2 1
Cell volume: 2076.36
Cell parameters: 14.33; 14.308; 10.127; 90; 90.2; 90;  

COD ID: 1509506
CIF file Formula: - Ag P2 Se6 V -
Comments: Brec, R.; Ouvrard, G. Modification of the cationic ordering with respect to the chalcogen in the layered M M' P2 X6 phases. Synthesis and structure of two-dimensional Ag V P2 Se6 Materials Research Bulletin 23 (1988) 1199-1209
Space group: C 1 2 1
Cell volume: 466.927
Cell parameters: 6.3399; 11.02; 6.9819; 90; 106.82; 90;  

COD ID: 1509759
CIF file Formula: - Ag26 I18 O16 W4 -
Comments: Chan, L.Y.Y.; Geller, S. Crystal structure and conductivity of 26-silver 18-iodide tetratungstate, Ag26 I18 W4 O16 Journal of Solid State Chemistry 21 (1977) 331-347
Space group: C 1 2 1
Cell volume: 2982
Cell parameters: 16.76; 15.52; 11.81; 90; 103.9; 90;  

COD ID: 1510883
CIF file Formula: - B2 Ba Cu O5 -
Comments: Keszler, D.A.; Smith, R.W. Synthesis, structure and properties of the noncentrosymmetric pyroborate Ba Cu B2 O5 Journal of Solid State Chemistry 129 (1997) 184-188
Space group: C 1 2 1
Cell volume: 234.663
Cell parameters: 6.485; 9.165; 3.971; 90; 96.14; 90;  

COD ID: 1511199
CIF file Formula: - B K2 Li O3 -
Comments: Hoppe, R.; Miessen, M. Neue Borate der Alkalimetalle:K2LiBo3 Physics and Chemistry of Minerals (Germany) 22 (1985) 331-343
Space group: C 1 2 1
Cell volume: 382.398
Cell parameters: 8.761; 6.081; 7.354; 90; 102.57; 90;  

COD ID: 1511452
CIF file Formula: - B Be2 Cs F2 O3 -
Comments: Podberezskaya, N.V.; Bakakin, V.V.; Baydina, I.A.; Bacanova, L.P.; Pal'chik, N.A.; Solov'eva, L.P. X-ray studies of the structure of beryllium borate-fluorides M Be2 (B O3) F2 where M=Na, K, Rb, Cs Zhurnal Strukturnoi Khimii (Issue-No. from 1981) 16 (1975) 1050-1053
Space group: C 1 2 1
Cell volume: 242.989
Cell parameters: 7.695; 4.446; 7.544; 90; 109.7; 90;  

COD ID: 1511455
CIF file Formula: - B Be2 F2 K O3 -
Comments: Bakakin, V.V.; Solov'eva, L.P. Crystal structure of potassium boratofluoroberyllate, K Be2 (B O3) F2 Kristallografiya 15 (1970) 922-925
Space group: C 1 2 1
Cell volume: 214.692
Cell parameters: 7.718; 4.444; 6.79; 90; 112.8; 90;  

COD ID: 1511456
CIF file Formula: - B Be2 F2 Na O3 -
Comments: Chen, C.-T.; Mei, L.-F.; Wang, Y.-B. Crystal structure of sodium beryllium borate fluoride Materials Research Bulletin 29 (1994) 81-87
Space group: C 1 2 1
Cell volume: 767.681
Cell parameters: 12.643; 8.729; 7.591; 90; 113.6; 90;  

COD ID: 1511457
CIF file Formula: - B Be2 F2 O3 Rb -
Comments: Podberezskaya, N.V.; Solov'eva, L.P.; Pal'chik, N.A.; Bakakin, V.V.; Baydina, I.A.; Bacanova, L.P. X-ray studies of the structure of beryllium borate-fluorides M Be2 (B O3) F2 where M=Na,K,Rb,Cs Zhurnal Strukturnoi Khimii (Issue-No. from 1981) 16 (1975) 1050-1053
Space group: C 1 2 1
Cell volume: 225.797
Cell parameters: 7.695; 4.441; 7.087; 90; 111.2; 90;  

COD ID: 1511530
CIF file Formula: - B5 Ca2 Os3 -
Comments: Schweitzer, K.; Jung, W. Darstellung und Kristallstruktur der isotypen Verbindungen Ca2 Os3 B5 und Eu2 Os3 B5 Zeitschrift fuer Anorganische und Allgemeine Chemie 533 (1986) 30-36
Space group: C 1 2 1
Cell volume: 281.118
Cell parameters: 13.304; 4.068; 7.998; 90; 139.5; 90;  

COD ID: 1511542
CIF file Formula: - B5 Eu2 Os3 -
Comments: Jung, W.; Schweitzer, K. Darstellung und Kristallstruktur der isotypen Verbindungen Ca2 Os3 B5 und Eu2 Os3 B5 Zeitschrift fuer Anorganische und Allgemeine Chemie 533 (1986) 30-36
Space group: C 1 2 1
Cell volume: 286.753
Cell parameters: 13.26; 4.071; 8.001; 90; 138.4; 90;  

COD ID: 1511860
CIF file Formula: - C22 H17 Br N4 O4 S -
Comments: Liu, Xiong-Li; Han, Wen-Yong; Zhang, Xiao-Mei; Yuan, Wei-Cheng Highly efficient and stereocontrolled construction of 3,3'-pyrrolidonyl spirooxindoles via organocatalytic domino Michael/cyclization reaction. Organic letters 15(6) (2013) 1246-1249
Space group: C 1 2 1
Cell volume: 2076.8
Cell parameters: 30.977; 6.0722; 11.0436; 90; 91.291; 90;  

COD ID: 1511918
CIF file Formula: - C16 H11 Cl O7 -
Comments: Suzuki, Takahiro; Miyajima, Yuria; Suzuki, Kaname; Iwakiri, Kanako; Koshimizu, Masaki; Hirai, Go; Sodeoka, Mikiko; Kobayashi, Susumu Unexpected Diels-Alder/Carbonyl-ene Cascade toward the Biomimetic Synthesis of Chloropupukeananin. Organic letters 15(7) (2013) 1748-1751
Space group: C 1 2 1
Cell volume: 2962.7
Cell parameters: 17.187; 7.3498; 23.976; 90; 101.984; 90;  

COD ID: 1511922
CIF file Formula: - C19 H19 F3 N2 O4 S -
Comments: Senczyszyn, Jemma; Brice, Heloise; Clayden, Jonathan Spirocyclic dihydropyridines by electrophile-induced dearomatizing cyclization of N-alkenyl pyridinecarboxamides. Organic letters 15(8) (2013) 1922-1925
Space group: C 1 2 1
Cell volume: 1876.47
Cell parameters: 23.483; 6.302; 13.176; 90; 105.776; 90;  

COD ID: 1512053
CIF file Formula: - C36 H52 N4 O5 -
Comments: Feng, Juhua; Fu, Xuan; Chen, Zhenling; Lin, Lili; Liu, Xiaohua; Feng, Xiaoming Efficient enantioselective synthesis of dihydropyrans using a chiral n,n'-dioxide as organocatalyst. Organic letters 15(11) (2013) 2640-2643
Space group: C 1 2 1
Cell volume: 8139.7
Cell parameters: 26.4401; 22.3692; 18.4184; 90; 131.651; 90;  

COD ID: 1512078
CIF file Formula: - C25 H43.5 O1.75 -
Comments: Xiao, Ze’en; Huang, Huarong; Shao, Changlun; Xia, Xuekui; Ma, Lin; Huang, Xishan; Lu, Yongjun; Lin, Yongcheng; Long, Yuhua; She, Zhigang Asperterpenols A and B, New Sesterterpenoids Isolated from a Mangrove Endophytic FungusAspergillussp. 085242 Organic Letters 15(10) (2013) 2522
Space group: C 1 2 1
Cell volume: 9277.05
Cell parameters: 29.5357; 15.7962; 20.0056; 90; 96.313; 90;  

COD ID: 1512143
CIF file Formula: - C17 H31 N3 O5 -
Comments: Cong, Hai-Jian; Zhang, Shu-Wei; Shen, Yu; Zheng, Yong; Huang, Yu-Jie; Wang, Wen-Qiong; Leng, Ying; Xuan, Li-Jiang Guanidine Alkaloids from Plumbago zeylanica. Journal of natural products 76(7) (2013) 1351-1357
Space group: C 1 2 1
Cell volume: 1987.08
Cell parameters: 19.4525; 6.8143; 14.9925; 90; 90.914; 90;  

COD ID: 1512269
CIF file Formula: - C27 H36 N2 O5 -
Comments: Silber, Johanna; Ohlendorf, Birgit; Labes, Antje; Näther, Christian; Imhoff, Johannes F. Calcaripeptides a-C, cyclodepsipeptides from a calcarisporium strain. Journal of natural products 76(8) (2013) 1461-1467
Space group: C 1 2 1
Cell volume: 13416.1
Cell parameters: 44.5917; 9.6204; 37.0616; 90; 122.453; 90;  

COD ID: 1512326
CIF file Formula: - C21 H22 N2 O3 -
Comments: Wu, Wenbin; Yuan, Xiaoqian; Hu, Juan; Wu, Xinxin; Wei, Yuan; Liu, Zunwu; Lu, Junzhu; Ye, Jinxing Catalytic Asymmetric Construction of Chiral Hydropyridazines via Conjugate Addition of N-Monosubstituted Hydrazones to Enones. Organic letters 15(17) (2013) 4524-4527
Space group: C 1 2 1
Cell volume: 1864.1
Cell parameters: 18.664; 8.2652; 12.1851; 90; 97.374; 90;  

COD ID: 1512439
CIF file Formula: - C48 H48 Ag3 F18 N8 O8 Sb3 -
Comments: Yue Zhao; Ling-Ling Zhai; Gao-Chao Lv; Xin Zhou; Wei-Yin Sun Silver(I) complexes with oxazoline-containing bidentate ligands: Syntheses, structures and properties Inorganica Chimica Acta 392 (2012) 38-45
Space group: C 1 2 1
Cell volume: 2945.9
Cell parameters: 31.9436; 8.2466; 11.1986; 90; 93.025; 90;  

COD ID: 1512563
CIF file Formula: - C25 H34 Cl N3 O -
Comments: Jones, Brian T.; Hu, Dennis X.; Savoie, Brett M.; Thomson, Regan J. Elimination of butylcycloheptylprodigiosin as a known natural product inspired by an evolutionary hypothesis for cyclic prodigiosin biosynthesis. Journal of natural products 76(10) (2013) 1937-1945
Space group: C 1 2 1
Cell volume: 4677
Cell parameters: 27.139; 8.776; 23.632; 90; 123.81; 90;  

COD ID: 1512589
CIF file Formula: - C35 H51 N3 O12 Si2 -
Comments: Pullin, Robert D. C.; Rathi, Akshat H.; Melikhova, Ekaterina Y.; Winter, Christian; Thompson, Amber L.; Donohoe, Timothy J. Tethered Aminohydroxylation: Synthesis of the β-Amino Acid of Microsclerodermins A and B. Organic letters 15(21) (2013) 5492-5495
Space group: C 1 2 1
Cell volume: 4071.2
Cell parameters: 23.9112; 6.492; 26.346; 90; 95.462; 90;  

COD ID: 1512739
CIF file Formula: - C22 H20 Cu F4 N2 O2 -
Comments: Katharina Butsch; Thomas Gunther; Axel Klein; Kathrin Stirnat; Albrecht Berkessel; Jorg Neudorfl Redox chemistry of copper complexes with various salen type ligands Inorganica Chimica Acta 393 (2012) 237-246
Space group: C 1 2 1
Cell volume: 3538.9
Cell parameters: 19.09; 16.624; 11.3624; 90; 101.063; 90;  

COD ID: 1512815
CIF file Formula: - C28 H20 Co N8 O12 -
Comments: Lian-Li Liu; Jing-Jing Huang; Xiu-Li Wang; Guo-Cheng Liu; Song Yang; Hong-Yan Lin Ligand-controlled assembly of cobalt(II) metal-organic complexes from different semirigid bis(imidazole) derivatives and aromatic monocarboxylates: Electrochemical behaviors and fluorescent properties Inorganica Chimica Acta 394 (2013) 715-722
Space group: C 1 2 1
Cell volume: 1534.8
Cell parameters: 22.432; 6.2562; 11.1; 90; 99.851; 90;  

COD ID: 1512973
CIF file Formula: - C31 H39 Cl Cu2 N4 O8 -
Comments: Pallab Bhowmik; Shouvik Chattopadhyay; Ashutosh Ghosh Synthesis and structure of mono-, di- and tri-nuclear copper(II) benzoate complexes with a tridentate N2O donor Schiff base ligand Inorganica Chimica Acta 396 (2013) 66-71
Space group: C 1 2 1
Cell volume: 1669.9
Cell parameters: 13.452; 17.648; 7.421; 90; 108.58; 90;  

COD ID: 1513033
CIF file Formula: - C12 H10 Ag N3 O5 -
Comments: Ivanova, Bojidarka; Spiteller, Michael Ag^I^ and Zn^II^ complexes with possible application as NLO materials ‒ Crystal structures and properties Polyhedron 30(2) (2011) 241-245
Space group: C 1 2 1
Cell volume: 665.4
Cell parameters: 22.541; 7.805; 3.786; 90; 92.533; 90;  

COD ID: 1513045
CIF file Formula: - C18 H23 N O4 -
Comments: Ivanova, Bojidarka; Spiteller, Michael Salts of aromatic amines: Crystal structures, spectroscopic and non-linear optical properties Spectrochimica Acta Part A 77 (2010) 849
Space group: C 1 2 1
Cell volume: 1655.7
Cell parameters: 18.1897; 6.5417; 13.9244; 90; 92.148; 90;  

COD ID: 1513072
CIF file Formula: - C17 H20 N2 O4.5 -
Comments: Ivanova, Bojidarka; Spiteller, Michael Organic mandelates as promising materials with non-linear optical application Structural Chemistry 21 (2010) 989
Space group: C 1 2 1
Cell volume: 1599
Cell parameters: 19.2; 5.508; 17.452; 90; 119.94; 90;  

COD ID: 1513111
CIF file Formula: - C22 H22 N4 O6 -
Comments: Zhang, Hongbo; Ning, Xin; Hang, Hang; Ru, Xuyan; Li, Haichen; Li, Yonghong; Wang, Lizhong; Zhang, Xiao; Yu, Shujing; Qiao, Yuanyuan; Wang, Xin; Wang, Peng George Total Synthesis of Thaxtomin A and Its Stereoisomers and Findings of Their Biological Activities Organic Letters 15(22) (2013) 5670
Space group: C 1 2 1
Cell volume: 2027.8
Cell parameters: 14.897; 6.8317; 20.38; 90; 102.13; 90;  

COD ID: 1513124
CIF file Formula: - C30 H33 Cl N2 O3 S -
Comments: Xu, Qing-Long; Zhuo, Chun-Xiang; Dai, Li-Xin; You, Shu-Li Highly Enantioselective Synthesis of TetrahydrocarbolinesviaIridium-Catalyzed Intramolecular Friedel‒Crafts Type Allylic Alkylation Reactions Organic Letters 15(23) (2013) 5909
Space group: C 1 2 1
Cell volume: 2725.1
Cell parameters: 37.404; 6.7314; 10.8232; 90; 90.249; 90;  

COD ID: 1513183
CIF file Formula: - C68 H76.75 Cd5 Cl4 N36 O29.5 -
Comments: Saugata Konar; Atanu Jana; Kinsuk Das; Sangita Ray; James A. Golen; Arnold L. Rheingold; Susanta Kumar Kar A rare pentanuclear cadmium(II) complex and two new mononuclear zinc(II) complexes of pyrazole derived ditopic ligands - Synthesis, crystal structures and spectral studies Inorganica Chimica Acta 397 (2013) 144-151
Space group: C 1 2 1
Cell volume: 9961
Cell parameters: 45.815; 13.88; 16.375; 90; 106.948; 90;  

COD ID: 1513222
CIF file Formula: - C29 H44 O11 -
Comments: Zheng, Yong; Zhang, Shu-Wei; Cong, Hai-Jian; Huang, Yu-Jie; Xuan, Li-Jiang Caesalminaxins A‒L, Cassane Diterpenoids from the Seeds ofCaesalpinia minax Journal of Natural Products 76(12) (2013) 2210
Space group: C 1 2 1
Cell volume: 3131.11
Cell parameters: 20.3979; 9.6961; 16.0481; 90; 99.429; 90;  

COD ID: 1513232
CIF file Formula: - C13 H10 I N O3 -
Comments: Murata, Yusuke; Takahashi, Masaki; Yagishita, Fumitoshi; Sakamoto, Masami; Sengoku, Tetsuya; Yoda, Hidemi Construction of Spiro-Fused 2-Oxindole/α-Methylene- γ-Butyrolactone Systems with Extremely High Enantioselectivity via Indium-Catalyzed Amide Allylation of N-Methyl Isatin. Organic letters 15(24) (2013) 6182-6185
Space group: C 1 2 1
Cell volume: 2524.3
Cell parameters: 20.2766; 11.0112; 13.5295; 90; 123.314; 90;  

COD ID: 1513343
CIF file Formula: - C28 H21 F6 N S -
Comments: Hirose, Takashi; Inoue, Yuki; Hasegawa, Jun-Ya; Higashiguchi, Kenji; Matsuda, Kenji Investigation on CD Inversion at Visible Region Caused by a Tilt of the π-Conjugated Substituent: Theoretical and Experimental Approaches by Using an Asymmetric Framework of Diarylethene Annulated Isomer. The journal of physical chemistry. A 118(6) (2014) 1084-1093
Space group: C 1 2 1
Cell volume: 4664.9
Cell parameters: 22.064; 10.5914; 22.751; 90; 118.669; 90;  

COD ID: 1513368
CIF file Formula: - C23 H31.5 N O4.5 -
Comments: Li, Yong; Wu, Chongming; Liu, Dong; Proksch, Peter; Guo, Peng; Lin, Wenhan Chartarlactams A-P, Phenylspirodrimanes from the Sponge-Associated Fungus Stachybotrys chartarum with Antihyperlipidemic Activities. Journal of natural products 77(1) (2014) 138-147
Space group: C 1 2 1
Cell volume: 2038.5
Cell parameters: 29.934; 7.8815; 8.732; 90; 98.3; 90;  

COD ID: 1513369
CIF file Formula: - C23 H30 N O5.5 -
Comments: Li, Yong; Wu, Chongming; Liu, Dong; Proksch, Peter; Guo, Peng; Lin, Wenhan Chartarlactams A-P, Phenylspirodrimanes from the Sponge-Associated Fungus Stachybotrys chartarum with Antihyperlipidemic Activities. Journal of natural products 77(1) (2014) 138-147
Space group: C 1 2 1
Cell volume: 2053.65
Cell parameters: 29.5456; 7.8704; 8.8858; 90; 96.335; 90;  

COD ID: 1513445
CIF file Formula: - C70 H78 N2 -
Comments: Castro-Fernández, Silvia; Lahoz, Inmaculada R.; Llamas-Saiz, Antonio L; Alonso-Gómez, José Lorenzo; Cid, María-Magdalena; Navarro-Vázquez, Armando Preparation and Characterization of a Halogen-Bonded Shape-Persistent Chiral Alleno-acetylenic Inclusion Complex. Organic letters 16(4) (2014) 1136-1139
Space group: C 1 2 1
Cell volume: 6777
Cell parameters: 33.2464; 6.863; 31.448; 90; 109.185; 90;  

COD ID: 1513464
CIF file Formula: - C27 H23 Br O3 S -
Comments: Wang, Shengzheng; Zhang, Yongqiang; Dong, Guoqiang; Wu, Shanchao; Fang, Kun; Li, Zhengang; Miao, Zhenyuan; Yao, Jianzhong; Li, Hao; Li, Jian; Zhang, Wannian; Wang, Wei; Sheng, Chunquan Facile Assembly of Chiral Tetrahydrothiopyrans Containing Four Consecutive Stereocenters via an Organocatalytic Enantioselective Michael-Michael Cascade. Organic letters 16(3) (2014) 692-695
Space group: C 1 2 1
Cell volume: 2304.7
Cell parameters: 31.361; 5.4611; 13.461; 90; 91.404; 90;  

COD ID: 1513481
CIF file Formula: - C13 H14 O4 -
Comments: Youn, So Won; Song, Hyoung Sub; Park, Jong Hyub Asymmetric Domino Multicatalysis for the Synthesis of 3-Substituted Phthalides: Cinchonine/NHC Cooperative System. Organic letters 16(3) (2014) 1028-1031
Space group: C 1 2 1
Cell volume: 4761.4
Cell parameters: 21.8649; 13.0933; 17.7804; 90; 110.708; 90;  

COD ID: 1513493
CIF file Formula: - C23 H38 N O4 P2 Pt -
Comments: Ou-Yang, Jiang-Kun; Zhang, Yan-Yan; He, Meng-Lan; Li, Jiang-Tao; Li, Xiaopeng; Zhao, Xiao-Li; Wang, Cui-Hong; Yu, Yihua; Wang, De-Xian; Xu, Lin; Yang, Hai-Bo Unexpected Self-Assembly of Chiral Triangles from 90° Chiral Di-Pt(II) Acceptors. Organic letters 16(3) (2014) 664-667
Space group: C 1 2 1
Cell volume: 2649.1
Cell parameters: 26.727; 9.8065; 10.1143; 90; 92.122; 90;  

COD ID: 1513802
CIF file Formula: - C36 H46 Cl N5 O6 S -
Comments: Gentles, Robert G.; Ding, Min; Bender, John A.; Bergstrom, Carl P.; Grant-Young, Katharine; Hewawasam, Piyasena; Hudyma, Thomas; Martin, Scott; Nickel, Andrew; Regueiro-Ren, Alicia; Tu, Yong; Yang, Zhong; Yeung, Kap-Sun; Zheng, Xiaofan; Chao, Sam; Sun, Jung-Hui; Beno, Brett R.; Camac, Daniel M.; Chang, Chong-Hwan; Gao, Mian; Morin, Paul E.; Sheriff, Steven; Tredup, Jeff; Wan, John; Witmer, Mark R.; Xie, Dianlin; Hanumegowda, Umesh; Knipe, Jay; Mosure, Kathy; Santone, Kenneth S.; Parker, Dawn D.; Zhuo, Xiaoliang; Lemm, Julie; Liu, Mengping; Pelosi, Lenore; Rigat, Karen; Voss, Stacey; Wang, Yi; Wang, Ying-Kai; Colonno, Richard J.; Gao, Min; Roberts, Susan B.; Gao, Qi; Ng, Alicia; Meanwell, Nicholas A.; Kadow, John F. Discovery and Preclinical Characterization of the Cyclopropylindolobenzazepine BMS-791325, A Potent Allosteric Inhibitor of the Hepatitis C Virus NS5B Polymerase. Journal of medicinal chemistry 57(5) (2014) 1855-1879
Space group: C 1 2 1
Cell volume: 3701.9
Cell parameters: 28.087; 11.9998; 10.9846; 90; 90.761; 90;  

COD ID: 1513835
CIF file Formula: - C46 H55 Cl3 N3 O P S2 -
Comments: He, Xiaoming; Lin, Jian-Bin; Kan, Wang Hay; Trudel, Simon; Baumgartner, Thomas Synthesis and properties of cholesteric click-phospholes. Organic letters 16(5) (2014) 1366-1369
Space group: C 1 2 1
Cell volume: 8834
Cell parameters: 35.727; 13.896; 19.912; 90; 116.668; 90;  

COD ID: 1513861
CIF file Formula: - C17 H21 O2 P -
Comments: Kortmann, Felix A.; Chang, Mu-Chieh; Otten, Edwin; Couzijn, Erik P. A.; Lutz, Martin; Minnaard, Adriaan J. Consecutive dynamic resolutions of phosphine oxides Chemical Science 5(4) (2014) 1322
Space group: C 1 2 1
Cell volume: 1522.01
Cell parameters: 21.4308; 6.089; 13.0171; 90; 116.36; 90;  

COD ID: 1513873
CIF file Formula: - C29 H25 O5 P -
Comments: Xu, Bin; Zhu, Shou-Fei; Zhang, Zhi-Chao; Yu, Zhi-Xiang; Ma, Yi; Zhou, Qi-Lin Highly enantioselective S‒H bond insertion cooperatively catalyzed by dirhodium complexes and chiral spiro phosphoric acids Chemical Science 5(4) (2014) 1442
Space group: C 1 2 1
Cell volume: 2320.9
Cell parameters: 25.33; 6.664; 16.09; 90; 121.291; 90;  

COD ID: 1514175
CIF file Formula: - C40 H50 O8 -
Comments: Feng, Yu; Ren, Fengxia; Niu, Shubin; Wang, Lin; Li, Li; Liu, Xingzhong; Che, Yongsheng Guanacastane Diterpenoids from the Plant Endophytic Fungus Cercospora sp. Journal of natural products 77(4) (2014) 873-881
Space group: C 1 2 1
Cell volume: 1736.13
Cell parameters: 12.8255; 11.1968; 12.6545; 90; 107.183; 90;  

COD ID: 1514209
CIF file Formula: - C28 H33 N3 O9 S2 -
Comments: Zhou, Jing; Yeung, Ying-Yeung N-Bromosuccinimide-Induced Aminocyclization-Aziridine Ring-Expansion Cascade: An Asymmetric and Highly Stereoselective Approach toward the Synthesis of Azepane. Organic letters 16(8) (2014) 2134-2137
Space group: C 1 2 1
Cell volume: 3008.7
Cell parameters: 29.758; 6.786; 16.7258; 90; 117.029; 90;  

COD ID: 1514213
CIF file Formula: - C28 H44 N O11 -
Comments: Zhang, Xiaofei; Cividino, Pascale; Poisson, Jean-François; Shpak-Kraievskyi, Pavlo; Laurent, Mathieu Y; Martel, Arnaud; Dujardin, Gilles; Py, Sandrine Asymmetric Synthesis of α,α-Disubstituted Amino Acids by Cycloaddition of (E)-Ketonitrones with Vinyl Ethers. Organic letters 16(7) (2014) 1936-1939
Space group: C 1 2 1
Cell volume: 3236.03
Cell parameters: 26.5845; 9.3012; 14.1691; 90; 112.536; 90;  

COD ID: 1514679
CIF file Formula: - C13 H13 Cl3 I N O2 -
Comments: Brindle, Cheyenne S.; Yeung, Charles S.; Jacobsen, Eric N. Chiral β-Iodoamines by Urea-Catalyzed Iodocyclization of Trichloroacetimidates. Chemical sciences journal 4(5) (2013) 2100
Space group: C 1 2 1
Cell volume: 1632.8
Cell parameters: 25.646; 6.3769; 10.8278; 90; 112.766; 90;  

COD ID: 1514694
CIF file Formula: - C19 H22 Br N O4 -
Comments: Eitel, Simon H.; Jautze, Sascha; Frey, Wolfgang; Peters, René Asymmetric Michael additions of α-cyanoacetates by soft Lewis acid/hard Brønsted acid catalysis: stereodivergency with bi- vs. monometallic catalysts Chemical Science 4(5) (2013) 2218
Space group: C 1 2 1
Cell volume: 1982
Cell parameters: 28.468; 6.5087; 10.903; 90; 101.161; 90;  

COD ID: 1514746
CIF file Formula: - C18 H17 F3 O2 -
Comments: Morrill, Louis C.; Douglas, James; Lebl, Tomas; Slawin, Alexandra M. Z.; Fox, David J.; Smith, Andrew D. Isothiourea-mediated asymmetric Michael-lactonisation of trifluoromethylenones: a synthetic and mechanistic study Chemical Science 4(11) (2013) 4146
Space group: C 1 2 1
Cell volume: 1492.4
Cell parameters: 19.358; 9.419; 8.186; 90; 90.979; 90;  

COD ID: 1514871
CIF file Formula: - C114.75 H48.75 Cl0.75 N4 Ni Sm -
Comments: Xu, Wei; Hao, Yajuan; Uhlik, Filip; Shi, Zujin; Slanina, Zdenêk; Feng, Lai Structural and electrochemical studies of Sm@D3h-C74 reveal a weak metal-cage interaction and a small band gap species. Nanoscale 5(21) (2013) 10409-10413
Space group: C 1 2 1
Cell volume: 7159
Cell parameters: 25.082; 14.877; 19.229; 90; 93.881; 90;  

COD ID: 1515045
CIF file Formula: - C21 H21 Br N2 O4 -
Comments: Zhong, Fangrui; Han, Xiaoyu; Wang, Youqing; Lu, Yixin Highly enantioselective [4 + 2] annulations catalyzed by amino acid-based phosphines: Synthesis of functionalized cyclohexenes and 3-spirocyclohexene-2-oxindoles Chemical Science 3(4) (2012) 1231
Space group: C 1 2 1
Cell volume: 2171.6
Cell parameters: 21.316; 6.3205; 17.4926; 90; 112.859; 90;  

COD ID: 1515353
CIF file Formula: - C22 H30 N4 O2 -
Comments: Lloyd, Gareth O.; Piepenbrock, Marc-Oliver M.; Foster, Jonathan A.; Clarke, Nigel; Steed, Jonathan W. Anion tuning of chiral bis(urea) low molecular weight gels Soft Matter 8(1) (2012) 204
Space group: C 1 2 1
Cell volume: 2080
Cell parameters: 35.285; 4.651; 12.784; 90; 97.518; 90;  

COD ID: 1515413
CIF file Formula: - C47 H59 Cl3 N4 O8 Si -
Comments: Knowles, Robert R.; Carpenter, Joseph; Blakey, Simon B.; Kayano, Akio; Mangion, Ian K.; Sinz, Christopher J.; Macmillan, David W. C. Total synthesis of diazonamide A. Chemical science (Royal Society of Chemistry : 2010) 2011(2) (2011) 308-311
Space group: C 1 2 1
Cell volume: 6499
Cell parameters: 19.546; 17.36; 19.889; 90; 105.63; 90;  

COD ID: 1515443
CIF file Formula: - C169 H123 F45 Fe4 N36 O31 S10 -
Comments: Hristova, Yana R.; Smulders, Maarten M. J.; Clegg, Jack K.; Breiner, Boris; Nitschke, Jonathan R. Selective anion binding by a “Chameleon” capsule with a dynamically reconfigurable exterior Chemical Science 2(4) (2011) 638
Space group: C 1 2 1
Cell volume: 23065
Cell parameters: 26.876; 38.443; 22.391; 90; 94.44; 90;  

COD ID: 1515531
CIF file Formula: - C63 H55 N2 O17.5 -
Comments: Adriaenssens, Louis; Severa, Lukáš; Koval, Dušan; Císařová, Ivana; Belmonte, Marta Martínez; Escudero-Adán, Eduardo C.; Novotná, Pavlína; Sázelová, Petra; Vávra, Jan; Pohl, Radek; Šaman, David; Urbanová, Marie; Kašička, Václav; Teplý, Filip [6]Saddlequat: a [6]helquat captured on its racemization pathway Chemical Science 2(12) (2011) 2314
Space group: C 1 2 1
Cell volume: 5403
Cell parameters: 24.233; 11.685; 20.507; 90; 111.491; 90;  

COD ID: 1515791
CIF file Formula: - C48.5 H29 Cl O4 P Pd0.25 -
Comments: Rueping, Magnus; Theissmann, Thomas Asymmetric Brønsted acid catalysis in aqueous solution Chemical Science 1(4) (2010) 473
Space group: C 1 2 1
Cell volume: 8555
Cell parameters: 25.774; 17.105; 22.731; 90; 121.38; 90;  

COD ID: 1515869
CIF file Formula: - C72 H74 B F24 Ir N O2 P -
Comments: Woodmansee, David H.; Müller, Marc-André; Neuburger, Marcus; Pfaltz, Andreas Chiral pyridyl phosphinites with large aryl substituents as efficient ligands for the asymmetric iridium-catalyzed hydrogenation of difficult substrates Chemical Science 1(1) (2010) 72
Space group: C 1 2 1
Cell volume: 14398.5
Cell parameters: 44.28; 12.7293; 25.6592; 90; 95.409; 90;  

COD ID: 1515917
CIF file Formula: - C21 H21 B F2 N2 O2 -
Comments: Filarowski, Aleksander; Kluba, Małgorzata; Cieślik-Boczula, Katarzyna; Koll, Aleksander; Kochel, Andrzej; Pandey, Lesley; De Borggraeve, Wim M.; Van der Auweraer, Mark; Catalán, Javier; Boens, Noël Generalized solvent scales as a tool for investigating solvent dependence of spectroscopic and kinetic parameters. Application to fluorescent BODIPY dyes. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 9(7) (2010) 996-1008
Space group: C 1 2 1
Cell volume: 1900.3
Cell parameters: 32.787; 7.992; 7.252; 90; 90.19; 90;  

COD ID: 1515948
CIF file Formula: - C28 H26 N2 O4 Ti -
Comments: Claffey, James; Deally, Anthony; Gleeson, Brendan; Hogan, Megan; Méndez, Luis Miguel Menéndez; Müller-Bunz, Helge; Patil, Siddappa; Wallis, Denise; Tacke, Matthias Pseudo-halide derivatives of titanocene: synthesis and cytotoxicity studies. Metallomics : integrated biometal science 1(6) (2009) 511-517
Space group: C 1 2 1
Cell volume: 1164.31
Cell parameters: 25.394; 7.3361; 6.313; 90; 98.11; 90;  

COD ID: 1515968
CIF file Formula: - C52 H82 N4 O23 -
Comments: Zhang, Jie; Guo, Dong-Sheng; Wang, Li-Hua; Wang, Zhen; Liu, Yu Supramolecular binary hydrogels from calixarenes and amino acids and their entrapment‒release of model dye molecules Soft Matter 7(5) (2011) 1756
Space group: C 1 2 1
Cell volume: 6012
Cell parameters: 19.723; 18.459; 17.842; 90; 112.245; 90;  

COD ID: 1516149
CIF file Formula: - C32.5 H31 Cl N2 O6 -
Comments: Zipfel, Hannes F.; Carreira, Erick M. An efficient synthesis strategy to the core structure of 6-5-6-5-6-membered epipolythiodiketopiperazines. Organic letters 16(11) (2014) 2854-2857
Space group: C 1 2 1
Cell volume: 6651.5
Cell parameters: 43.265; 15.0547; 10.2366; 90; 93.976; 90;  

COD ID: 1516286
CIF file Formula: - C6 H22 N2 Na2 O10 S2 Zn -
Comments: Mroué, Kamal H; Power, William P. High-field solid-state (67)Zn NMR spectroscopy of several zinc-amino acid complexes. The journal of physical chemistry. A 114(1) (2010) 324-335
Space group: C 1 2 1
Cell volume: 1804.67
Cell parameters: 5.1893; 23.2065; 15.0008; 90; 92.561; 90;  

COD ID: 1516464
CIF file Formula: - C26 H30 Cl N2 O4 -
Comments: Xu, Jianfeng; Mou, Chengli; Zhu, Tingshun; Song, Bao-An; Chi, Yonggui Robin N-heterocyclic carbene-catalyzed chemoselective cross-aza-benzoin reaction of enals with isatin-derived ketimines: access to chiral quaternary aminooxindoles. Organic letters 16(12) (2014) 3272-3275
Space group: C 1 2 1
Cell volume: 2543.1
Cell parameters: 21.651; 8.9952; 13.072; 90; 92.662; 90;  

COD ID: 1516633
CIF file Formula: - C9 H15 N O3 S -
Comments: Choudhary, Amit; Newberry, Robert W.; Raines, Ronald T. n→π* Interactions Engender Chirality in Carbonyl Groups. Organic letters 16(13) (2014) 3421-3423
Space group: C 1 2 1
Cell volume: 1090.6
Cell parameters: 14.493; 6.393; 11.849; 90; 96.568; 90;  

COD ID: 1516742
CIF file Formula: - C27 H33 F O8 -
Comments: Morton, Gillian E.; Barrett, Anthony G. M. Iterative benzyne-furan cycloaddition reactions: studies toward the total synthesis of ent-Sch 47554 and ent-Sch 47555. Organic letters 8(13) (2006) 2859-2861
Space group: C 1 2 1
Cell volume: 2630.2
Cell parameters: 38.884; 8.6698; 7.8123; 90; 92.945; 90;  

COD ID: 1516971
CIF file Formula: - C21 H17 Br O2 -
Comments: Li, Lijun; Su, Cunxiang; Liu, Xiaoqin; Tian, Hua; Shi, Yian Catalytic Asymmetric Intermolecular Bromoesterification of Unfunctionalized Olefins. Organic letters 16(14) (2014) 3728
Space group: C 1 2 1
Cell volume: 1700.7
Cell parameters: 20.888; 7.515; 14.089; 90; 129.736; 90;  

COD ID: 1517234
CIF file Formula: - C16 H17 N O2 S -
Comments: Su, Lin; Zhu, Ting-Shun; Xu, Ming-Hua Indium-Mediated Asymmetric Intramolecular Allenylation of N-tert-Butanesulfinyl Imines: Efficient and Practical Access to Chiral 3-Allenyl-4-aminochromanes. Organic letters 16(16) (2014) 4118-4121
Space group: C 1 2 1
Cell volume: 1620.59
Cell parameters: 19.1174; 6.6815; 13.5889; 90; 110.988; 90;  

COD ID: 1517282
CIF file Formula: - C27 H32 F3 N O3 -
Comments: Han, Zhengxu S.; Xu, Yibo; Fandrick, Daniel R.; Rodriguez, Sonia; Li, Zhibin; Qu, Bo; Gonnella, Nina C.; Sanyal, Sanjit; Reeves, Jonathan T.; Ma, Shengli; Grinberg, Nelu; Haddad, Nizar; Krishnamurthy, Dhileep; Song, Jinhua J.; Yee, Nathan K.; Pfrengle, Waldemar; Ostermeier, Markus; Schnaubelt, Jürgen; Leuter, Zeno; Steigmiller, Sonja; Däubler, Jürgen; Stehle, Emanuel; Neumann, Lukas; Trieselmann, Thomas; Tielmann, Patrick; Buba, Annette; Hamm, Rainer; Koch, Gunter; Renner, Svenja; Dehli, Juan R.; Schmelcher, Florian; Stange, Christian; Mack, Jürgen; Soyka, Rainer; Senanayake, Chris H. Facile entry to an efficient and practical enantioselective synthesis of a polycyclic cholesteryl ester transfer protein inhibitor. Organic letters 16(16) (2014) 4142-4145
Space group: C 1 2 1
Cell volume: 2522.6
Cell parameters: 27.7938; 6.3604; 18.1051; 90; 127.987; 90;  

COD ID: 1517383
CIF file Formula: - C18 H20 N2 O6 S2 -
Comments: Meng, Ling-Hong; Li, Xiao-Ming; Lv, Cui-Ting; Huang, Cai-Guo; Wang, Bin-Gui Brocazines A-F, Cytotoxic Bisthiodiketopiperazine Derivatives from Penicillium brocae MA-231, an Endophytic Fungus Derived from the Marine Mangrove Plant Avicennia marina. Journal of natural products 77(8) (2014) 1921
Space group: C 1 2 1
Cell volume: 982.74
Cell parameters: 16.7824; 8.1768; 7.5091; 90; 107.502; 90;  

COD ID: 1517508
CIF file Formula: - C24 H28 N2 O4 S2 -
Comments: Bailey, Stephen J.; Wales, Steven M.; Willis, Anthony C.; Keller, Paul A. Ring-opening and -expansion of 2,2'-biaziridine: access to diverse enantiopure linear and bicyclic vicinal diamines. Organic letters 16(16) (2014) 4344-4347
Space group: C 1 2 1
Cell volume: 2349.02
Cell parameters: 24.6086; 7.9486; 15.1824; 90; 127.722; 90;  

COD ID: 1517621
CIF file Formula: - C26 H24 Cu2 N14 O8 -
Comments: Mohd. R. Razali; Aron Urbatsch; Glen B. Deacon; Stuart R. Batten Coordination polymers of transition metals derived from the in situ nucleophilic addition of alcohols to dicyanonitrosomethanide [C(CN)2(NO)]- Inorganica Chimica Acta 403 (2013) 120-126
Space group: C 1 2 1
Cell volume: 3165.2
Cell parameters: 15.4005; 15.4356; 13.3294; 90; 92.652; 90;  

COD ID: 1517664
CIF file Formula: - C27 H45 Cl O -
Comments: Jing, Yuanyuan; Daniliuc, Constantin G.; Studer, Armido Direct Conversion of Alcohols to α-Chloro Aldehydes and α-Chloro Ketones. Organic letters 16(18) (2014) 4932-4935
Space group: C 1 2 1
Cell volume: 7531.8
Cell parameters: 62.156; 6.5176; 18.9764; 90; 101.552; 90;  

COD ID: 1517828
CIF file Formula: - C33 H26 N4 O13 -
Comments: Fernández de la Pradilla, Roberto; Velado, Marina; Colomer, Ignacio; Simal, Carmen; Viso, Alma; Gornitzka, Heinz; Hemmert, Catherine Remote stereocontrol in the synthesis of acyclic 1,4-diols and 1,4-aminoalcohols from 2-sulfinyl dienes. Organic letters 16(19) (2014) 5200-5203
Space group: C 1 2 1
Cell volume: 3251.1
Cell parameters: 31.994; 6.1028; 16.831; 90; 98.394; 90;  

COD ID: 1517863
CIF file Formula: - C10 H21 N2 Ni O5 S2 Tl -
Comments: Muller, A.; Johannes, K. U.; Straube, M.; Krickemeyer, R.; Bogge, H. Penicillamine complexes of nickel, chromium, and molybdenum - structural particularity and biological/medical relevance Zeitschrift fuer Anorganische und Allgemeine Chemie 619 (1993) 1037-1046
Space group: C 1 2 1
Cell volume: 1664.8
Cell parameters: 22.799; 6.131; 12.752; 90; 110.94; 90;  

COD ID: 1517864
CIF file Formula: - C10 H18 Cr N2 O4 S2 Tl -
Comments: Muller, A.; Johannes, K. U.; Straube, M.; Krickemeyer, R.; Bogge, H. Penicillamine complexes of nickel, chromium, and molybdenum - structural particularity and biological/medical relevance Zeitschrift fuer Anorganische und Allgemeine Chemie 619 (1993) 1037-1046
Space group: C 1 2 1
Cell volume: 736.9
Cell parameters: 20.54; 5.921; 6.067; 90; 92.89; 90;  

COD ID: 1517947
CIF file Formula: - C9 H16 O6 -
Comments: Matviitsuk, Anastassia; Berndt, Falko; Mahrwald, Rainer Four into one: organocatalyzed stereoselective conjugate addition of unprotected and unactivated carbohydrates. Organic letters 16(20) (2014) 5474-5477
Space group: C 1 2 1
Cell volume: 1050.76
Cell parameters: 17.8456; 5.5103; 12.4607; 90; 120.958; 90;  

COD ID: 1517961
CIF file Formula: - C19 H17 N O6 S -
Comments: Engl, Oliver D.; Fritz, Sven P.; Käslin, Alexander; Wennemers, Helma Organocatalytic route to dihydrocoumarins and dihydroquinolinones in all stereochemical configurations. Organic letters 16(20) (2014) 5454-5457
Space group: C 1 2 1
Cell volume: 1746.49
Cell parameters: 24.1913; 6.4335; 11.2245; 90; 91.281; 90;  

COD ID: 1517990
CIF file Formula: - C197.82 H137.82 Cl5.46 -
Comments: Matsuno, Taisuke; Sato, Sota; Iizuka, Ryosuke; Isobe, Hiroyuki Molecular recognition in curved π-systems: effects of π-lengthening of tubular molecules on thermodynamics and structures Chem. Sci. 6(2) (2015) 909
Space group: C 1 2 1
Cell volume: 29229
Cell parameters: 53.108; 21.244; 26.197; 90; 98.53; 90;  

COD ID: 1518067
CIF file Formula: - C15 H20 O3 -
Comments: Huang, An-Cheng; Sumby, Christopher J.; Tiekink, Edward R. T.; Taylor, Dennis K. Synthesis of guaia-4(5)-en-11-ol, guaia-5(6)-en-11-ol, aciphyllene, 1-epi-melicodenones C and E, and other guaiane-type sesquiterpenoids via the diastereoselective epoxidation of guaiol. Journal of natural products 77(11) (2014) 2522-2536
Space group: C 1 2 1
Cell volume: 1304.14
Cell parameters: 14.368; 5.5232; 16.9484; 90; 104.156; 90;  

COD ID: 1518073
CIF file Formula: - C22 H18 O6 -
Comments: Dang, Hai-Yan; Wang, Zi-Tian; Cheng, Ying Changing reaction pathways of the dimerization of 2-formylcinnamates by N-heterocyclic carbene/lewis Acid cooperative catalysis: an unusual cleavage of the carbon-carbon bond. Organic letters 16(21) (2014) 5520-5523
Space group: C 1 2 1
Cell volume: 876.8
Cell parameters: 21.979; 3.805; 12.816; 90; 125.112; 90;  

COD ID: 1518152
CIF file Formula: - C19.5 H19 Br N O3.5 -
Comments: He, Ling; Zhao, Liang; Wang, De-Xian; Wang, Mei-Xiang Catalytic asymmetric difunctionalization of stable tertiary enamides with salicylaldehydes: highly efficient, enantioselective, and diastereoselective synthesis of diverse 4-chromanol derivatives. Organic letters 16(22) (2014) 5972-5975
Space group: C 1 2 1
Cell volume: 1827.7
Cell parameters: 14.001; 10.574; 13.214; 90; 110.89; 90;  

COD ID: 1518235
CIF file Formula: - C15 H33 N O5 S -
Comments: Maolanon, Alex R.; Villadsen, Jesper S.; Christensen, Niels J.; Hoeck, Casper; Friis, Tina; Harris, Pernille; Gotfredsen, Charlotte H.; Fristrup, Peter; Olsen, Christian A. Methyl effect in azumamides provides insight into histone deacetylase inhibition by macrocycles. Journal of medicinal chemistry 57(22) (2014) 9644-9657
Space group: C 1 2 1
Cell volume: 1916.7
Cell parameters: 17.9092; 6.1043; 17.9815; 90; 102.833; 90;  

COD ID: 1518275
CIF file Formula: - C14 H19 N O -
Comments: Cui, Xin; Xu, Xue; Jin, Li-Mei; Wojtas, Lukasz; Zhang, X. Peter Stereoselective Radical C-H Alkylation with Acceptor/Acceptor-Substituted Diazo Reagents via Co(II)-Based Metalloradical Catalysis. Chemical science (Royal Society of Chemistry : 2010) 6(2) (2015) 1219-1224
Space group: C 1 2 1
Cell volume: 1267.04
Cell parameters: 7.0592; 9.6718; 18.5618; 90; 91.179; 90;  

COD ID: 1518338
CIF file Formula: - C36 H54 F18 N15 P3 Ru3 S9 -
Comments: Zubi, Ahmed; Wragg, Ashley; Turega, Simon; Adams, Harry; Costa, Paulo J.; Félix, Vítor; Thomas, Jim A. Modulating the electron-transfer properties of a mixed-valence system through host‒guest chemistry Chem. Sci. 6(2) (2015) 1334
Space group: C 1 2 1
Cell volume: 6053.6
Cell parameters: 27.5079; 16.0629; 14.4082; 90; 108.033; 90;  

COD ID: 1518417
CIF file Formula: - C17 H23 Br O5 -
Comments: Shockley, Samantha E.; Holder, Jeffrey C.; Stoltz, Brian M. A catalytic, enantioselective formal synthesis of (+)-dichroanone and (+)-taiwaniaquinone H. Organic letters 16(24) (2014) 6362-6365
Space group: C 1 2 1
Cell volume: 1683.57
Cell parameters: 18.8295; 7.8451; 11.4443; 90; 95.208; 90;  

COD ID: 1518451
CIF file Formula: - C33 H31.75 N2 O5.88 -
Comments: Raeburn, Jaclyn; Mendoza-Cuenca, Cristina; Cattoz, Beatrice N.; Little, Marc A.; Terry, Ann E.; Zamith Cardoso, Andre; Griffiths, Peter C.; Adams, Dave J. The effect of solvent choice on the gelation and final hydrogel properties of Fmoc-diphenylalanine. Soft matter 11(5) (2015) 927-935
Space group: C 1 2 1
Cell volume: 5761
Cell parameters: 52.27; 5.01; 22.83; 90; 105.49; 90;  

COD ID: 1518456
CIF file Formula: - C21 H28 O4 S -
Comments: Lan, Ping; Banwell, Martin G.; Willis, Anthony C. Chemoenzymatic Synthesis of the Enantiomer of 4,12-Dihydroxysterpurene, the Structure Assigned to a Metabolite Isolated from the Culture Broth of Stereum purpureum. Organic letters 17(1) (2015) 166-169
Space group: C 1 2 1
Cell volume: 1996.45
Cell parameters: 19.3925; 6.0017; 17.9993; 90; 107.635; 90;  

COD ID: 1518461
CIF file Formula: - C24 H21 Cl2 N O4 -
Comments: Liu, Ze-Shui; Li, Wen-Ke; Kang, Tai-Ran; He, Long; Liu, Quan-Zhong Palladium-catalyzed asymmetric cycloadditions of vinylcyclopropanes and in situ formed unsaturated imines: construction of structurally and optically enriched spiroindolenines. Organic letters 17(1) (2015) 150-153
Space group: C 1 2 1
Cell volume: 5550.3
Cell parameters: 21.3083; 16.6395; 17.8923; 90; 118.967; 90;  

COD ID: 1518466
CIF file Formula: - C24.5 H26.52 O7 -
Comments: McDonald, Benjamin R.; Nibbs, Antoinette E.; Scheidt, Karl A. A biomimetic strategy to access the silybins: total synthesis of (-)-isosilybin a. Organic letters 17(1) (2015) 98-101
Space group: C 1 2 1
Cell volume: 4372.4
Cell parameters: 43.491; 5.5109; 18.3225; 90; 95.331; 90;  

COD ID: 1518597
CIF file Formula: - C25 H22 F4 P2 -
Comments: Holthausen, Michael H.; Hiranandani, Rashi R.; Stephan, Douglas W. Electrophilic bis-fluorophosphonium dications: Lewis acid catalysts from diphosphines Chem. Sci. 6(3) (2015) 2016
Space group: C 1 2 1
Cell volume: 1098.76
Cell parameters: 21.0973; 8.3882; 6.3567; 90; 102.383; 90;  

COD ID: 1518716
CIF file Formula: - C42 H55 Cl2 N5 O10 -
Comments: Rose, Tristan E.; Lawson, Kenneth V.; Harran, Patrick. G. Large ring-forming alkylations provide facile access to composite macrocycles Chem. Sci. 6(4) (2015) 2219
Space group: C 1 2 1
Cell volume: 4288.1
Cell parameters: 25.187; 8.1556; 21.154; 90; 99.308; 90;  

COD ID: 1518774
CIF file Formula: - C17 H24 O6 -
Comments: Gao, Chun; Han, Li; Zheng, Dan; Jin, Hongwei; Gai, Chunyan; Wang, Jianbin; Zhang, Hao; Zhang, Liangren; Fu, Hongzheng Dimeric Abietane Diterpenoids and Sesquiterpenoid Lactones from Teucrium viscidum. Journal of natural products 78(4) (2015) 630-638
Space group: C 1 2 1
Cell volume: 1740
Cell parameters: 19.391; 6.455; 15.383; 90; 115.322; 90;  

COD ID: 1518862
CIF file Formula: - Ir Te2 -
Comments: Pascut, G. L.; Birol, T.; Gutmann, M. J.; Yang, J. J.; Cheong, S.-W.; Haule, K.; Kiryukhin, V. Series of alternating states with unpolarized and spin-polarized bands in dimerized <span class="aps-inline-formula"><math xmlns="http://www.w3.org/1998/Math/MathML"><msub><mi>IrTe</mi><mn>2</mn></msub></math></span> Physical Review B 90(19) (2014) 195122
Space group: C 1 2 1
Cell volume: 1141.04
Cell parameters: 12.7036; 3.9646; 22.6796; 90; 92.642; 90;  

COD ID: 1518906
CIF file Formula: - C34 H18 O2 -
Comments: Sbargoud, Kamal; Mamada, Masashi; Marrot, Jérôme; Tokito, Shizuo; Yassar, Abderrahim; Frigoli, Michel Diindeno[1,2-b:2′,1′-n]perylene: a closed shell related Chichibabin's hydrocarbon, the synthesis, molecular packing, electronic and charge transport properties Chem. Sci. 6(6) (2015) 3402
Space group: C 1 2 1
Cell volume: 1122.6
Cell parameters: 13.707; 6.3468; 13.269; 90; 103.472; 90;  

COD ID: 1519441
CIF file Formula: - C28 H28 O4 -
Comments: Verrier, Charlie; Melchiorre, Paolo Diastereodivergent organocatalysis for the asymmetric synthesis of chiral annulated furans Chem. Sci. 6(7) (2015) 4242
Space group: C 1 2 1
Cell volume: 2330.5
Cell parameters: 22.183; 7.95; 15.744; 90; 122.929; 90;  

COD ID: 1519474
CIF file Formula: - C32 H40 N2 O8 -
Comments: Jones, Ray C.F.; Horton, Peter N.; Hursthouse, Michael B. C32H40N2O8 Crystal Structure Report Archive (2002) 941
Space group: C 1 2 1
Cell volume: 3109.8
Cell parameters: 19.403; 8.9915; 17.855; 90; 93.313; 90;  

COD ID: 1519634
CIF file Formula: - C63.2 H72.55 I6 N13.06 Zn3 -
Comments: Yoshioka, Shota; Inokuma, Yasuhide; Hoshino, Manabu; Sato, Takashi; Fujita, Makoto Absolute structure determination of compounds with axial and planar chirality using the crystalline sponge method Chem. Sci. 6(7) (2015) 3765
Space group: C 1 2 1
Cell volume: 15782.8
Cell parameters: 35.1081; 14.6516; 31.3279; 90; 101.649; 90;  

COD ID: 1519635
CIF file Formula: - C60.26 H61.53 I6 N14 Zn3 -
Comments: Yoshioka, Shota; Inokuma, Yasuhide; Hoshino, Manabu; Sato, Takashi; Fujita, Makoto Absolute structure determination of compounds with axial and planar chirality using the crystalline sponge method Chem. Sci. 6(7) (2015) 3765
Space group: C 1 2 1
Cell volume: 15964.2
Cell parameters: 35.2721; 14.6427; 31.6037; 90; 102.029; 90;  

COD ID: 1519636
CIF file Formula: - C84.5 H64 I12.04 N24 S0.5 Zn6 -
Comments: Yoshioka, Shota; Inokuma, Yasuhide; Hoshino, Manabu; Sato, Takashi; Fujita, Makoto Absolute structure determination of compounds with axial and planar chirality using the crystalline sponge method Chem. Sci. 6(7) (2015) 3765
Space group: C 1 2 1
Cell volume: 15999.8
Cell parameters: 34.8299; 14.9133; 31.5387; 90; 102.403; 90;  

COD ID: 1519637
CIF file Formula: - C87.64 H68.04 I12 N24 S0.62 Zn6 -
Comments: Yoshioka, Shota; Inokuma, Yasuhide; Hoshino, Manabu; Sato, Takashi; Fujita, Makoto Absolute structure determination of compounds with axial and planar chirality using the crystalline sponge method Chem. Sci. 6(7) (2015) 3765
Space group: C 1 2 1
Cell volume: 15263.4
Cell parameters: 34.4391; 15.0959; 29.9556; 90; 101.454; 90;  

COD ID: 1519638
CIF file Formula: - C85.6 H63.3 I12 N24 O1.7 Zn6 -
Comments: Yoshioka, Shota; Inokuma, Yasuhide; Hoshino, Manabu; Sato, Takashi; Fujita, Makoto Absolute structure determination of compounds with axial and planar chirality using the crystalline sponge method Chem. Sci. 6(7) (2015) 3765
Space group: C 1 2 1
Cell volume: 15665
Cell parameters: 34.2; 15.1265; 31.003; 90; 102.385; 90;  

COD ID: 1519639
CIF file Formula: - C86.95 H64.82 I12 N24 O1.87 Zn6 -
Comments: Yoshioka, Shota; Inokuma, Yasuhide; Hoshino, Manabu; Sato, Takashi; Fujita, Makoto Absolute structure determination of compounds with axial and planar chirality using the crystalline sponge method Chem. Sci. 6(7) (2015) 3765
Space group: C 1 2 1
Cell volume: 15886
Cell parameters: 34.627; 15.0818; 31.194; 90; 102.792; 90;  

COD ID: 1520168
CIF file Formula: - C47 H100 N4 O12 -
Comments: Callear, Samantha K.; Hursthouse, Michael B. Di-1,1,3,3-tetramethylbutylammonium glutarate hemiglutaric acid Crystal Structure Report Archive (2008) 524
Space group: C 1 2 1
Cell volume: 2727.7
Cell parameters: 23.089; 6.403; 18.496; 90; 94.025; 90;  

COD ID: 1520257
CIF file Formula: - C7 H20 B5 N O11 -
Comments: Beckett, Michael A.; Horton, Peter N.; Hursthouse, Michael B. C7H20B5NO11 Crystal Structure Report Archive (2008) 428
Space group: C 1 2 1
Cell volume: 1606.95
Cell parameters: 14.7118; 11.4599; 9.8194; 90; 103.911; 90;  

COD ID: 1520346
CIF file Formula: - C21 H26 O9 S -
Comments: Croft, Anna K.; Tizzard, Graham J.; Hursthouse, Michael B. Acetic acid 4,5-diacetoxy-6-acetoxymethyl-2-benzylsulfanyl- tetrahydro-pyran-3-yl ester Crystal Structure Report Archive (2009) 858
Space group: C 1 2 1
Cell volume: 2207.36
Cell parameters: 18.9488; 5.6024; 20.7934; 90; 90.355; 90;  

COD ID: 1520501
CIF file Formula: - C6 H23 Al3 N4 O17 P4 -
Comments: N. Simon; T. Loiseau; G. Ferey Synthesis and crystal structure of MIL-32: a new chiral layered aluminophosphate templated with non chiral tris(2-aminoethyl)amine: Al3(PO4)4, N4C6H21, H2O Solid State Sciences 2 (2000) 391-397
Space group: C 1 2 1
Cell volume: 2298.11
Cell parameters: 19.1418; 8.5274; 14.545; 90; 104.543; 90;  

COD ID: 1520529
CIF file Formula: - C51 H30 Co3 N3 O12 -
Comments: Aggarwal, Himanshu; Das, Raj Kumar; Bhatt, Prashant M.; Barbour, Leonard J. Isolation of a structural intermediate during switching of degree of interpenetration in a metal‒organic framework Chem. Sci. 6(8) (2015) 4986
Space group: C 1 2 1
Cell volume: 4694
Cell parameters: 17.173; 19.784; 13.887; 90; 95.771; 90;  

COD ID: 1520530
CIF file Formula: - C51 H30 Co3 N3 O12 -
Comments: Aggarwal, Himanshu; Das, Raj Kumar; Bhatt, Prashant M.; Barbour, Leonard J. Isolation of a structural intermediate during switching of degree of interpenetration in a metal‒organic framework Chem. Sci. 6(8) (2015) 4986
Space group: C 1 2 1
Cell volume: 4692.7
Cell parameters: 17.0391; 20.0278; 13.8334; 90; 96.243; 90;  

COD ID: 1520623
CIF file Formula: - C22 H44 F0.5 N0.5 O7 -
Comments: Engle, Keary M.; Pfeifer, Lukas; Pidgeon, George W.; Giuffredi, Guy T.; Thompson, Amber L.; Paton, Robert S.; Brown, John M.; Gouverneur, Véronique Coordination diversity in hydrogen-bonded homoleptic fluoride‒alcohol complexes modulates reactivity Chem. Sci. 6(9) (2015) 5293
Space group: C 1 2 1
Cell volume: 2594.06
Cell parameters: 25.1923; 9.6565; 10.6715; 90; 92.2457; 90;  

COD ID: 1520680
CIF file Formula: - C18 H37 Br N4 -
Comments: Springborg, Johan; Pretzmann, Ulla; Olsen, Carl Erik; Sotofte, Inger Crystal Structures of Salts of Mono- and Triprotonated [36]Adamanzane, 1,5,9,13-Tetraazatricyclo[7.7.3.3(5,13)]docosane, and Equilibrium Studies of the Reactions between Mono-, Di- and Triprotonated Species, Respectively, Having None, One and Two Lone Pairs Pointing Outwards Acta Chemica Scandinavica 52 (1998) 289-295
Space group: C 1 2 1
Cell volume: 1919
Cell parameters: 15.232; 8.786; 15.22; 90; 109.59; 90;  

COD ID: 1520720
CIF file Formula: - C21 H31 Cl3 O2 -
Comments: Wang, Li-Jun; Xiong, Juan; Liu, Shu-Ting; Pan, Li-Long; Yang, Guo-Xun; Hu, Jin-Feng ent-Abietane-Type and Related Seco-/Nor-diterpenoids from the Rare Chloranthaceae Plant Chloranthus sessilifolius and Their Antineuroinflammatory Activities. Journal of natural products 78(7) (2015) 1635-1646
Space group: C 1 2 1
Cell volume: 4280.19
Cell parameters: 22.6971; 11.6034; 19.6097; 90; 124.027; 90;  

COD ID: 1520956
CIF file Formula: - C34 H46 Cl In N4 O2 -
Comments: Aluthge, D. C.; Ahn, J. M.; Mehrkhodavandi, P. Overcoming aggregation in indium salen catalysts for isoselective lactide polymerization Chem. Sci. 6(9) (2015) 5284
Space group: C 1 2 1
Cell volume: 6733.3
Cell parameters: 36.78; 8.3688; 24.188; 90; 115.26; 90;  

COD ID: 1521067
CIF file Formula: - Ca1.747 O7 Sm0.253 Ta1.84 Ti0.16 -
Comments: Grey, I.E.; Roth, R.S. New calcium tantalate polytypes in the system Ca2 Ta2 O7 Sm2 Ti2 O7 Journal of Solid State Chemistry 150 (2000) 167-177
Space group: C 1 2 1
Cell volume: 2809.48
Cell parameters: 12.763; 7.31; 30.19; 90; 94.09; 90;  

COD ID: 1524223
CIF file Formula: - Fe Rh2 Se2 -
Comments: Chul Sung Kim; In Bo Shim Corstallographic and magnetic properties of Cu Rh2 Se4 - Fe Rh2 Se4 Series Chinese Journal of Physics (Peking) (English Translation) 28 (1990) 15-27
Space group: C 1 2 1
Cell volume: 255.791
Cell parameters: 12.569; 3.643; 6.31; 90; 117.71; 90;  

COD ID: 1524378
CIF file Formula: - S8 Tl V5 -
Comments: Founes, L.; Vlasse, M.; Saux, M. Preparation, properties and crystal structure of Tl V5 S8 Materials Research Bulletin 12 (1977) 1-6
Space group: C 1 2 1
Cell volume: 476.672
Cell parameters: 17.465; 3.301; 8.519; 90; 103.94; 90;  

COD ID: 1525208
CIF file Formula: - Cu4 Ni S7 Si2 -
Comments: Schaefer, W.; Nitsche, R.; Scheunemann, K. Crystal structure and magnetic properties of Cu4 Ni Si2 S7 Materials Research Bulletin 15 (1980) 933-937
Space group: C 1 2 1
Cell volume: 495.298
Cell parameters: 11.551; 5.313; 8.165; 90; 98.72; 90;  

COD ID: 1525556
CIF file Formula: - Al5.3 H8 O18 Si3.2 -
Comments: Aleksandrova, V.A.; Drits, V.A.; Sokolova, G.V. Structural features of Dioctahedral one-packet chlorite Kristallografiya 17 (1972) 525-532
Space group: C 1 2 1
Cell volume: 654.619
Cell parameters: 5.174; 8.956; 14.26; 90; 97.833; 90;  

COD ID: 1525917
CIF file Formula: - C16 H36 N4 O72 Si36 -
Comments: Marler, B.; Werthmann, U.; Gies, H. Synthesis and structure of pure silica-RUB-10 (structure type: RUT)obtained with pyrrolidine as the structure directing agent Microporous and Mesoporous Materials 43 (2001) 329-340
Space group: C 1 2 1
Cell volume: 2022.15
Cell parameters: 13.3395; 13.1753; 12.5916; 90; 113.97; 90;  

COD ID: 1526160
CIF file Formula: - Ca2 O7 Ta2 -
Comments: Grey, I.E.; Planes, J.; Roth, R.S.; Mumme, W.G.; Chenavas, J.; Bendersky, L.A.; Li, C. Characterization of new 5M and 7M polytypes of niobia-doped Ca2 Ta2 O7 Journal of Solid State Chemistry 161 (2001) 274-287
Space group: C 1 2 1
Cell volume: 3958.02
Cell parameters: 12.726; 7.38; 42.358; 90; 95.77; 90;  

COD ID: 1526162
CIF file Formula: - Ca2 Nb0.1 O7 Ta1.9 -
Comments: Grey, I.E.; Chenavas, J.; Mumme, W.G.; Roth, R.S.; Bendersky, L.A.; Planes, J.; Li, C. Characterization of new 5M and 7M polytypes of niobia-doped Ca2 Ta2O7 Journal of Solid State Chemistry 161 (2001) 274-287
Space group: C 1 2 1
Cell volume: 3961.35
Cell parameters: 12.717; 7.3728; 42.464; 90; 95.755; 90;  

COD ID: 1526164
CIF file Formula: - Ca2 Nb0.2 O7 Ta1.8 -
Comments: Grey, I.E.; Roth, R.S.; Li, C.; Mumme, W.G.; Planes, J.; Bendersky, L.A.; Chenavas, J. Characterization of new 5M and 7M polytypes of niobia-doped Ca2 Ta2O7 Journal of Solid State Chemistry 161 (2001) 274-287
Space group: C 1 2 1
Cell volume: 2826.8
Cell parameters: 12.7528; 7.3492; 30.2442; 90; 94.245; 90;  

COD ID: 1526578
CIF file Formula: - Li N2 Na5 -
Comments: Schoen, J.C.; Wevers, M.A.C.; Jansen, M. Investigation of the possible ternary nitrides in the system (Li3 N)/(Na3 N) Solid State Sciences 2 (2000) 449-456
Space group: C 1 2 1
Cell volume: 255.324
Cell parameters: 6.731; 5.944; 6.383; 90; 91.18; 90;  

COD ID: 1526644
CIF file Formula: - Al O4 P -
Comments: Kirchner, R.M.; Grosse-Kunstleve, R.W.; Pluth, J.J.; Broach, R.W.; Wilson, S.T.; Smith, J.V. The structures of as-synthesized Al P O4 - 53(A), calcined dehydrated Al P O4 - 53(B), and Al P O4 - 53(C), a new phase determined by the FOCUS method Microporous and Mesoporous Materials 39 (2000) 319-332
Space group: C 1 2 1
Cell volume: 1132.02
Cell parameters: 16.44398; 5.1075; 13.4846; 90; 88.259; 90;  

COD ID: 1526706
CIF file Formula: - F4 H8 N4 O6 Sn2 -
Comments: Kokunov, Yu.V.; Detkov, D.G.; Gorbunova, Yu.E.; Ershova, M.M.; Buslaev, Yu.A.; Mikhailov, Yu.N. Crystal structure of (N H4)2 Sn2 F4 (N O3)2 - first example of dimer complexes (Sn2 F4 E2) in tin(II) fluorides Doklady Akad. Nauk 378 (2001) 347-350
Space group: C 1 2 1
Cell volume: 541.336
Cell parameters: 14.897; 5.412; 7.167; 90; 110.47; 90;  

COD ID: 1526724
CIF file Formula: - Cr K P2 S7 -
Comments: Kopnin, E.; Coste, S.; Jobic, S.; Evain, M.; Brec, R. Synthesis and crystal structure determination of three layered-type thiophosphate compounds K M P2 S7 (M = Cr, V, In) Materials Research Bulletin 35 (2000) 1401-1410
Space group: C 1 2 1
Cell volume: 509.588
Cell parameters: 8.5146; 9.5848; 6.3052; 90; 97.981; 90;  

COD ID: 1526726
CIF file Formula: - In K P2 S7 -
Comments: Kopnin, E.; Coste, S.; Jobic, S.; Brec, R.; Evain, M. Synthesis and crystal structure determination of three layered-typethiophosphate compounds K M P2 S7 (M = Cr, V, In) Materials Research Bulletin 35 (2000) 1401-1410
Space group: C 1 2 1
Cell volume: 544.227
Cell parameters: 8.7506; 9.9685; 6.3151; 90; 98.906; 90;  

COD ID: 1526728
CIF file Formula: - K P2 S7 V -
Comments: Kopnin, E.; Coste, S.; Brec, R.; Jobic, S.; Evain, M. Synthesis and crystal structure determination of three layered-typethiophosphate compounds K M P2 S7 (M = Cr, V, In) Materials Research Bulletin 35 (2000) 1401-1410
Space group: C 1 2 1
Cell volume: 512.93
Cell parameters: 8.5553; 9.5765; 6.3323; 90; 98.63; 90;  

COD ID: 1527259
CIF file Formula: - Cl3 Cu Rb -
Comments: Crama, W.J. The cooperative Jahn-Teller distorted structure of Rb Cu Cl3 Journal of Solid State Chemistry 39 (1981) 168-172
Space group: C 1 2 1
Cell volume: 999.31
Cell parameters: 11.932; 6.844; 12.244; 90; 91.93; 90;  

COD ID: 1527609
CIF file Formula: - C3 H K N3 O0.5 Se3 -
Comments: Hauge, S.; Sletten, J. The crystal structure of potassium triselenocyanate hemihydrate Acta Chemica Scandinavica (1-27,1973-42,1988) 25 (1971) 3094-3102
Space group: C 1 2 1
Cell volume: 1771.71
Cell parameters: 16.988; 4.443; 23.59; 90; 95.7; 90;  

COD ID: 1528243
CIF file Formula: - Cr I3 Rb -
Comments: Zandbergen, H.W.; Ijdo, D.J.W. Neutron powder diffraction on Rb Cr I3 and magnetic measurements on Rb Cr I3 and Cs Cr I3 Journal of Solid State Chemistry 38 (1981) 199-210
Space group: C 1 2 1
Cell volume: 1506.18
Cell parameters: 13.586; 7.923; 14.094; 90; 96.88; 90;  

COD ID: 1528352
CIF file Formula: - B21 H18 K -
Comments: Bernhardt, E.; Brauer, D.J.; Finze, M.; Willner, H. closo-[B21 H18](-): A face-fused diicosahedral borate ion Angewandte Chemie (Edition international) 46 (2007) 2927-2930
Space group: C 1 2 1
Cell volume: 1500.01
Cell parameters: 12.486; 7.106; 16.9436; 90; 93.81; 90;  

COD ID: 1528382
CIF file Formula: - As2 Mo -
Comments: Brown, A. Structure data for some arsenic- and germanium-rich compounds of molybdenum Nature (London) 206 (1965) 502-503
Space group: C 1 2 1
Cell volume: 201.289
Cell parameters: 9.067; 3.3; 7.718; 90; 119.35; 90;  

COD ID: 1528508
CIF file Formula: - Bi10 Mo3 O24 -
Comments: Galy, J.; Hernandez-Velasco, J.; Landa-Canovas, A.R.; Castro, A.; Vila, E. Ab initio structure determination and Rietveld refinement of Bi10 Mo3 O24 the member n=3 of the Bi(2n+4) Mo(n) O6(n+1) series Journal of Solid State Chemistry 182 (2009) 1177-1187
Space group: C 1 2 1
Cell volume: 1157.62
Cell parameters: 23.7282; 5.64906; 8.68173; 90; 95.8668; 90;  

COD ID: 1529085
CIF file Formula: - C70 H76 N4 -
Comments: Sanna, Elena; Escudero-Adán, Eduardo C.; Bauzá, Antonio; Ballester, Pablo; Frontera, Antonio; Rotger, Carmen; Costa, Antonio A crystalline sponge based on dispersive forces suitable for X-ray structure determination of included molecular guests Chem. Sci. 6(10) (2015) 5466
Space group: C 1 2 1
Cell volume: 5657.1
Cell parameters: 34.833; 5.8219; 28.205; 90; 98.49; 90;  

COD ID: 1529087
CIF file Formula: - C70 H74 N6 -
Comments: Sanna, Elena; Escudero-Adán, Eduardo C.; Bauzá, Antonio; Ballester, Pablo; Frontera, Antonio; Rotger, Carmen; Costa, Antonio A crystalline sponge based on dispersive forces suitable for X-ray structure determination of included molecular guests Chem. Sci. 6(10) (2015) 5466
Space group: C 1 2 1
Cell volume: 6069
Cell parameters: 35.689; 5.9481; 28.84; 90; 97.562; 90;  

COD ID: 1529395
CIF file Formula: - C9 H13 I O4 -
Comments: Lan, Ping; White, Lauren E.; Taher, Ehab S.; Guest, Prudence E.; Banwell, Martin G.; Willis, Anthony C. Chemoenzymatic Synthesis of (+)-Asperpentyn and the Enantiomer of the Structure Assigned to Aspergillusol A. Journal of natural products 78(8) (2015) 1963-1968
Space group: C 1 2 1
Cell volume: 1098.78
Cell parameters: 17.7416; 5.1188; 12.1148; 90; 92.9213; 90;  

COD ID: 1529474
CIF file Formula: - C15 H21 I O -
Comments: Shen, Zhigao; Pan, Xixian; Lai, Yisheng; Hu, Jiadong; Wan, Xiaolong; Li, Xiaoge; Zhang, Hui; Xie, Weiqing Chiral ion-pair organocatalyst promotes highly enantioselective 3-exo iodo-cycloetherification of allyl alcohols Chem. Sci. 6(12) (2015) 6986
Space group: C 1 2 1
Cell volume: 1534.3
Cell parameters: 22.448; 6.0248; 11.443; 90; 97.517; 90;  

COD ID: 1529506
CIF file Formula: - C19 H16 O2 -
Comments: Lin, Che-Hung; Pursley, Dominik; Klein, Johannes E. M. N.; Teske, Johannes; Allen, Jennifer A.; Rami, Fabian; Köhn, Andreas; Plietker, Bernd Non-decarbonylative photochemical versus thermal activation of Bu4N[Fe(CO)3(NO)] ‒ the Fe-catalyzed Cloke‒Wilson rearrangement of vinyl and arylcyclopropanes Chem. Sci. 6(12) (2015) 7034
Space group: C 1 2 1
Cell volume: 1504.78
Cell parameters: 14.321; 8.9769; 11.71; 90; 91.66; 90;  

COD ID: 1529508
CIF file Formula: - C19 H16 O2 -
Comments: Lin, Che-Hung; Pursley, Dominik; Klein, Johannes E. M. N.; Teske, Johannes; Allen, Jennifer A.; Rami, Fabian; Köhn, Andreas; Plietker, Bernd Non-decarbonylative photochemical versus thermal activation of Bu4N[Fe(CO)3(NO)] ‒ the Fe-catalyzed Cloke‒Wilson rearrangement of vinyl and arylcyclopropanes Chem. Sci. 6(12) (2015) 7034
Space group: C 1 2 1
Cell volume: 1504.61
Cell parameters: 14.3185; 8.9738; 11.7148; 90; 91.675; 90;  

COD ID: 1529618
CIF file Formula: - Al3 B4 Gd O12 -
Comments: Belokoneva, E.L.; Pashkova, A.V.; Belov, N.V.; Timchenko, T.I. The crystal structure of a new monoclinic modification of high-temperature tr-Al-borate Gd Al3 (B O3)4 Doklady Akademii Nauk SSSR 261 (1981) 361-365
Space group: C 1 2 1
Cell volume: 1089.44
Cell parameters: 7.227; 9.315; 16.184; 90; 90.57; 90;  

COD ID: 1529823
CIF file Formula: - Cs F4 H4 Mn O2 -
Comments: Dubler, E.; Linowsky, L.; Oswald, H.R.; Matthieu, J.P. Synthese, Kristallstruktur und thermische Entwaesserung von Cs Mn F4 (H2 O)2 Helvetica Chimica Acta 60 (1977) 1589-1600
Space group: C 1 2 1
Cell volume: 619.932
Cell parameters: 11.891; 6.589; 10.558; 90; 131.46; 90;  

COD ID: 1530631
CIF file Formula: - H Li O3 P Tl -
Comments: Rafiq, M.; Durand, J.; Cot, L. Sur quelques phosphites doubles de cations monovalents de la serie Li M P O3 H, (H2 O)x. Etude structurale de Li Tl P O3 H Revue de Chimie Minerale 18 (1981) 1-18
Space group: C 1 2 1
Cell volume: 387.485
Cell parameters: 14.284; 5.091; 5.329; 90; 89.19; 90;  

COD ID: 1530696
CIF file Formula: - C27 H21 N1.5 O6 P1.5 -
Comments: Abbassi, Leïla; Chabre, Yoann M.; Kottari, Naresh; Arnold, Alexandre A.; André, Sabine; Josserand, Johan; Gabius, Hans-Joachim; Roy, René Multifaceted glycodendrimers with programmable bioactivity through convergent, divergent, and accelerated approaches using polyfunctional cyclotriphosphazenes Polym. Chem. 6(44) (2015) 7666
Space group: C 1 2 1
Cell volume: 2375
Cell parameters: 18.901; 7.5595; 17.833; 90; 111.235; 90;  

COD ID: 1530751
CIF file Formula: - Ge4 O9 Pb -
Comments: Shashkov, A.Yu.; Rannev, N.V.; Venevtsev, Yu.N. The crystal structure of lead gamma-tetragermanate Zhurnal Neorganicheskoi Khimii 26 (1981) 2926-2928
Space group: C 1 2 1
Cell volume: 352.472
Cell parameters: 7.328; 11.447; 6.822; 90; 141.98; 90;  

COD ID: 1530790
CIF file Formula: - Mo2.4 O16 V3.6 -
Comments: Slade, R.C.T.; West, B.C.; Ramanan, A.; Prince, E. The Structure of V9 Mo6 O40 Determined by Powder Neutron Diffraction Journal of Solid State Chemistry 82 (1989) 65-69
Space group: C 1 2 1
Cell volume: 289.247
Cell parameters: 19.3611; 3.625; 4.1215; 90; 90.617; 90;  

COD ID: 1531045
CIF file Formula: - C38.5 H29 Cl O4 -
Comments: Wang, De; Wang, Guo-Peng; Sun, Yao-Liang; Zhu, Shou-Fei; Wei, Yin; Zhou, Qi-Lin; Shi, Min Chiral phosphine-catalyzed tunable cycloaddition reactions of allenoates with benzofuranone-derived olefins for a highly regio-, diastereo- and enantioselective synthesis of spiro-benzofuranones Chem. Sci. 6(12) (2015) 7319
Space group: C 1 2 1
Cell volume: 3075.9
Cell parameters: 16.8074; 10.9989; 16.649; 90; 92.018; 90;  

COD ID: 1532212
CIF file Formula: - B10 Ba2 H2 Na2 O19 -
Comments: Vinogradova, S.A.; Arakcheeva, A.V.; Pushcharovskii, D.Yu.; Dimitrova, O.V. Crystal structure of new decaborate Na2 Ba2 (B10 O17 (O H)2) Kristallografiya 47 (2002) 30-34
Space group: C 1 2 1
Cell volume: 714.21
Cell parameters: 11.455; 6.675; 9.36; 90; 93.68; 90;  

COD ID: 1532294
CIF file Formula: - F2 H3 K3 O8 S2 -
Comments: Troyanov, S.I.; Kosterina, E.V.; Kemnitz, E. Synthesis and crystal structure of adducts of alkali metal salts and (H F) -(K3 (S O4) (H S O4)) * 2(H F), (Cs H2 P O3) * (H F) and Cs4 (Se O4) (H Se O4)2 * (H F) with F - H...O type hydrogen bonds Zhurnal Neorganicheskoi Khimii 46 (2001) 1496-1502
Space group: C 1 2 1
Cell volume: 990.761
Cell parameters: 20.567; 6.177; 8.257; 90; 109.18; 90;  

COD ID: 1532467
CIF file Formula: - C11 H7 F2 N3 O3 S -
Comments: Zhang, Huatang; Liu, Ruochuan; Liu, Jie; Li, Lin; Wang, Ping; Yao, Shao Q.; Xu, Zhengtao; Sun, Hongyan A minimalist fluorescent probe for differentiating Cys, Hcy and GSH in live cells Chem. Sci. 7(1) (2016) 256
Space group: C 1 2 1
Cell volume: 1236.2
Cell parameters: 26.261; 5.162; 9.7804; 90; 111.188; 90;  

COD ID: 1534018
CIF file Formula: - Ge H28 Na4 O14 Se4 -
Comments: Krebs, B.; Jacobsen, H.J. Darstellung und Struktur von Na4 Ge Se4 (H2 O)14 Zeitschrift fuer Anorganische und Allgemeine Chemie 421 (1976) 97-104
Space group: C 1 2 1
Cell volume: 1119.58
Cell parameters: 12.862; 11.205; 8.141; 90; 107.4; 90;  

COD ID: 1534159
CIF file Formula: - O6 V2 Zn -
Comments: Angenault, J.; Rimsky, A. Structure cristalline de la phase Zn V2 O6 Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie C, Sciences Chimiques (1966-) 267 (1968) 227-230
Space group: C 1 2 1
Cell volume: 199.254
Cell parameters: 9.242; 3.526; 6.574; 90; 111.55; 90;  

COD ID: 1534170
CIF file Formula: - F Nb31 O77 -
Comments: Astroem, A. The crystal structure of Nb31 O77 F and Nb17 O42 F Acta Chemica Scandinavica (1-27,1973-42,1988) 20 (1966) 969-982
Space group: C 1 2 1
Cell volume: 3045.1
Cell parameters: 37.53999; 3.832; 21.17999; 90; 91.92; 90;  

COD ID: 1534348
CIF file Formula: - C20 H32 O3 -
Comments: Du, Kun; De Mieri, Maria; Neuburger, Markus; Zietsman, Pieter C.; Marston, Andrew; van Vuuren, Sandy F.; Ferreira, Daneel; Hamburger, Matthias; van der Westhuizen, Jan H. Labdane and Clerodane Diterpenoids from Colophospermum mopane. Journal of natural products 78(10) (2015) 2494-2504
Space group: C 1 2 1
Cell volume: 3635.4
Cell parameters: 33.5582; 7.4109; 14.7554; 90; 97.8284; 90;  

COD ID: 1534749
CIF file Formula: - Al1.7 F1.62 H0.38 K Li1.48 Mg0.39 O10.38 Si3.43 -
Comments: Backhaus, K.O. Structure refinement of an 1 M-Lepidolite Crystal Research and Technology 18 (1983) 1253-1260
Space group: C 1 2 1
Cell volume: 465.38
Cell parameters: 5.216; 9.005; 10.084; 90; 100.72; 90;  

COD ID: 1535456
CIF file Formula: - Al3.28 F3.16 Fe0.24 H1.08 K2 Li2.54 Mn O20.84 Si6.68 -
Comments: Mizota, T.; Kato, T.; Harada, K. The crystal structure of masutomilite, Mn analogue of zinnwaldite Mineralogical Journal (Japan) 13 (1986) 13-21
Space group: C 1 2 1
Cell volume: 474.839
Cell parameters: 5.262; 9.102; 10.094; 90; 100.83; 90;  

COD ID: 1535706
CIF file Formula: - Ga1.2 Na1.24 Se4 Sn0.81 -
Comments: Hwang Seong-Ju; Iyer, R.G.; Kanatzidis, M. Quaternary selenostannates Na(2-x) Ga(2-x) Sn(1+x) Se6 and A Ga Sn Se4 (A= K, Rb, and Cs) through rapid cooling of melts. Kinetics versus thermodynamics in the polymorphism of A Ga Sn Se4 Journal of Solid State Chemistry 177 (2004) 3640-3649
Space group: C 1 2 1
Cell volume: 1226.59
Cell parameters: 13.308; 7.5935; 13.842; 90; 118.73; 90;  

COD ID: 1535738
CIF file Formula: - Nb6 O16 U -
Comments: Busch, J.; Hoffmann, G.; Gruehn, R. Darstellung, Kristallstruktur und elektronenmikroskopische Untersuchung von U Nb6 O16 - einem neuen niobreichen Oxid im System U/Nb/O Zeitschrift fuer Anorganische und Allgemeine Chemie 620 (1994) 1056-1065
Space group: C 1 2 1
Cell volume: 605.922
Cell parameters: 22.339; 3.775; 7.249; 90; 97.61; 90;  

COD ID: 1535749
CIF file Formula: - Cs H Mn O10 P3 -
Comments: Murashova, E.V.; Chudinova, N.N. Crystal structure of double triphosphate Cs Mn H P3 O10 Kristallografiya 40 (1995) 476-484
Space group: C 1 2 1
Cell volume: 463.789
Cell parameters: 8.994; 8.629; 6.511; 90; 113.39; 90;  

COD ID: 1535990
CIF file Formula: - Mo O8 V2 -
Comments: Eick, H.A.; Kihlborg, L. The crystal structure of V2 Mo O8 Acta Chemica Scandinavica (1-27,1973-42,1988) 20 (1966) 1658-1666
Space group: C 1 2 1
Cell volume: 289.813
Cell parameters: 19.398; 3.629; 4.117; 90; 90.34; 90;  

COD ID: 1536791
CIF file Formula: - Ba Mn2 O14 Si4 Sr2 -
Comments: Yamnova, N.A.; Pushcharovskii, D.Yu.; Kalacheva, L.V.; Kalinin, V.V. Crystal structure of taikanite Sr2 Ba Mn2 (Si4 O12) O2 Kristallografiya 37 (1992) 613-616
Space group: C 1 2 1
Cell volume: 581.776
Cell parameters: 14.59; 7.769; 5.141; 90; 93.28; 90;  

COD ID: 1536857
CIF file Formula: - H82 Na16 O81 Si16 -
Comments: Rastsvetaeva, R.K.; Yamnova, N.A.; Mikheeva, M.G.; Pushcharovskii, D.Yu.; Khomyakov, A.P. Crystal structure of revdite Na16 (Si4 O6 (OH)5)2 (Si8 O15 (O H)6) (O H)10 (H2 O)28. Kristallografiya 37 (1992) 1177-1184
Space group: C 1 2 1
Cell volume: 3681.7
Cell parameters: 53.83; 9.972; 6.907; 90; 96.78; 90;  

COD ID: 1537094
CIF file Formula: - Al2.02 Fe0.92 H2 K0.9 Li0.2 O12 Si3.18 -
Comments: Zhukhlistov, A.P.; Shuriga, T.N.; Zvyagin, B.B. Electron-.diffraction investigation fo the crystal structure of di-trioctahedral Li, Fe-phengite 1M Kristallografiya 28 (1983) 874-879
Space group: C 1 2 1
Cell volume: 478.875
Cell parameters: 5.282; 9.141; 10.11; 90; 101.18; 90;  

COD ID: 1537346
CIF file Formula: - F5 H2 K2 Mo O2 -
Comments: Grandjean, D.; Weiss, R. Etude structurale des complexes oxofluores et oxoperoxofluores du molybdene V et VI. IV. - Structure cristalline de l'oxopentafluoromolybdate de potassium a une molecule d'eau Bulletin de la Societe Chimique de France (Vol=Year) 1967 (1967) 3054-3058
Space group: C 1 2 1
Cell volume: 651.012
Cell parameters: 8.533; 8.508; 9.107; 90; 100.05; 90;  

COD ID: 1537460
CIF file Formula: - Hg2 P2 S7 -
Comments: Jandali, M.Z.; Eulenberger, G.; Hahn, H. Darstellung und Kristallstruktur des Quecksilber(II)-Thiodiphosphats Hg2 P2 S7 Zeitschrift fuer Anorganische und Allgemeine Chemie 445 (1978) 184-192
Space group: C 1 2 1
Cell volume: 500.926
Cell parameters: 10.887; 5.827; 8.132; 90; 103.83; 90;  

COD ID: 1537546
CIF file Formula: - Mn0.47 Mo1.06 O6 V0.94 -
Comments: Kozlowski, R.; Stadnicka, K. Defect Structures in the Brannerite-Type Vanadates. IV. The Crystal Structure of Mn1-x ()x V2-2x Mo2x O6, x =.53 Journal of Solid State Chemistry 39 (1981) 271-276
Space group: C 1 2 1
Cell volume: 215.131
Cell parameters: 9.412; 3.643; 6.767; 90; 112; 90;  

COD ID: 1538417
CIF file Formula: - O7 V2 W -
Comments: Mondet, S.; Rimsky, A.; Borene, J.; Freundlich, W. Structure cristalline de la phase W V2 O7 Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie C, Sciences Chimiques (1966-) 266 (1968) 1145-1148
Space group: C 1 2 1
Cell volume: 717.067
Cell parameters: 24.4; 7.44; 3.95; 90; 90; 90;  

COD ID: 1539746
CIF file Formula: - H12 Nd2 O24 P6 -
Comments: Elmokhtar, O.S.M.; Rzaigui, M. Preparation, characterization and crystal structure of neodymium cyclohexaphosphate hexahydrate: Nd2 P6 O18 . 6 (H2 O) Bulletin des Societes chimiques Belges 105 (1996) 307-315
Space group: C 1 2 1
Cell volume: 2738.7
Cell parameters: 24.58; 9.2; 12.14; 90; 93.97; 90;  

COD ID: 1540067
CIF file Formula: - Ni5 Sb2 -
Comments: Heinrich, S.; Rexer, H.U.; Schubert, K. Kristallstruktur von Ni5 Sb2 Journal of the Less-Common Metals 60 (1978) 65-74
Space group: C 1 2 1
Cell volume: 381.486
Cell parameters: 12.9458; 5.4271; 11.4568; 90; 151.71; 90;  

COD ID: 1540477
CIF file Formula: - C18 H21 N O4 -
Comments: Shen, De-Yang; Nguyen, Thi Ngan; Wu, Shwu-Jen; Shiao, Young-Ji; Hung, Hsin-Yi; Kuo, Ping-Chung; Kuo, Daih-Huang; Thang, Tran Dinh; Wu, Tian-Shung γ- and δ-Lactams from the Leaves of Clausena lansium. Journal of natural products 78(11) (2015) 2521-2530
Space group: C 1 2 1
Cell volume: 1689.47
Cell parameters: 14.0792; 6.7979; 17.748; 90; 95.958; 90;  

COD ID: 1540532
CIF file Formula: - C47 H65 N O5 -
Comments: Peng, Jing; Chen, Chao; Xi, Chanjuan β-Arylation of oxime ethers using diaryliodonium salts through activation of inert C(sp3)‒H bonds using a palladium catalyst Chem. Sci. 7(2) (2016) 1383
Space group: C 1 2 1
Cell volume: 4299.9
Cell parameters: 35.188; 7.4837; 16.526; 90; 98.87; 90;  

COD ID: 1540622
CIF file Formula: - C27 H20 Cl F3 N2 O3 -
Comments: Zhou, Ding; Huang, Zheng; Yu, Xueting; Wang, Youxin; Li, Jian; Wang, Wei; Xie, Hexin A Quinine-Squaramide Catalyzed Enantioselective Aza-Friedel-Crafts Reaction of Cyclic Trifluoromethyl Ketimines with Naphthols and Electron-Rich Phenols. Organic letters 17(22) (2015) 5554-5557
Space group: C 1 2 1
Cell volume: 2672.8
Cell parameters: 19.9301; 11.6169; 12.0116; 90; 106.035; 90;  

COD ID: 1540693
CIF file Formula: - C39 H45 Cl9 N6 O6 -
Comments: Kieryk, Przemysław; Janczak, Jan; Panek, Jarosław; Miklitz, Marcin; Lisowski, Jerzy Chiral 2 + 3 Keto-Enamine Pseudocyclophanes Derived from 1,3,5-Triformylphloroglucinol. Organic letters 18(1) (2016) 12-15
Space group: C 1 2 1
Cell volume: 4698.4
Cell parameters: 19.477; 24.208; 13.2882; 90; 131.418; 90;  

COD ID: 1540694
CIF file Formula: - C39 H45 Cl9 N6 O6 -
Comments: Kieryk, Przemysław; Janczak, Jan; Panek, Jarosław; Miklitz, Marcin; Lisowski, Jerzy Chiral 2 + 3 Keto-Enamine Pseudocyclophanes Derived from 1,3,5-Triformylphloroglucinol. Organic letters 18(1) (2016) 12-15
Space group: C 1 2 1
Cell volume: 4685.8
Cell parameters: 19.47; 24.1563; 13.2943; 90; 131.46; 90;  

COD ID: 1540867
CIF file Formula: - Ho S -
Comments: van Smaalen, S.; Petricek, V. Refinement of incommensurate structures against diffraction data from a twinned crystal Journal of Alloys Compd. 178 (1992) 369-378
Space group: C 1 2 1
Cell volume: 677.982
Cell parameters: 5.396; 5.661; 22.195; 90; 90.19; 90;  

COD ID: 1540868
CIF file Formula: - Nb S2 -
Comments: van Smaalen, S.; Petricek, V. Refinement of incommensurate structures against diffraction data from a twinned crystal Journal of Alloys Compd. 178 (1992) 369-378
Space group: C 1 2 1
Cell volume: 416.587
Cell parameters: 3.312; 5.661; 22.25; 90; 93.03; 90;  

COD ID: 1541091
CIF file Formula: - Li2 Ni P2 S6 -
Comments: Patel, S.N.; Balchin, A.A. Preparation and structural studies of lithium-substituted nickel phosphorus trisulphide, Li2 Ni P2 S6 Solid State Ionics 20 (1986) 223-224
Space group: C 1 2 1
Cell volume: 420.961
Cell parameters: 5.926; 10.917; 6.718; 90; 104.4; 90;  


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