Crystallography Open Database

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Searching space group like 'P 1'

COD ID: 1000459
CIF file	Formula: - C H22 Al2 Ca4 O20 - Comments: Francois, M; Renaudin, G; Evrard, O A cementitious compound with composition 3CaO . Al2O3 . CaCO3 . 11H2O Acta Crystallographica C (39,1983-) 54 (1998) 1214-1217 Space group: P 1 Cell volume: 433 Cell parameters: 5.7747; 8.4689; 9.923; 64.77; 82.75; 81.43;

COD ID: 1001844
CIF file	Formula: - F12 H2 Np3 O - Comments: Cousson, A; Abazli, H; Pages, M; Gasperin, M Tetrafluorure de Neptunium Hydrate, Np3 F12 1. 1H H2 O Acta Crystallographica C (39,1983-) 39 (1983) 425-427 Space group: P 1 Cell volume: 465.2 Cell parameters: 8.455; 8.858; 8.396; 113.83; 116.64; 58.03;

COD ID: 1004039
CIF file	Formula: - B Cl4 K O12 S4 - Comments: Mairesse, G; Drache, M The crystal structure of potassium tetrachlorosulfatoborate, K (B (S O~3~ Cl)~4~) Acta Crystallographica B (24,1968-38,1982) 34 (1978) 1771-1776 Space group: P 1 Cell volume: 811.7 Cell parameters: 10.513; 10.838; 10.965; 99.21; 135.48; 97.15;

COD ID: 1007093
CIF file	Formula: - Ce H8 N2 O15 P5 - Comments: Rzaigui, M; Ariguib, K; Averbuch-Pouchot, M T; Durif, A Crystal Structure of Cerium(III) Diammonium Polyphosphate (N H~4~)~2~ Ce (P O3)5 Journal of Solid State Chemistry 50 (1983) 240-246 Space group: P 1 Cell volume: 665.7 Cell parameters: 7.241; 13.314; 7.241; 90.35; 107.5; 90.28;

COD ID: 1007133
CIF file	Formula: - Ce O14 P5 - Comments: Rzaigui, M; Kbir Ariguib, N; Averbuch-Pouchot, M T; Durif, A Crystal Structure of Triclinic Ce P~5~ O~14~: A New Type of Ultraphosphate Journal of Solid State Chemistry 52 (1984) 61-65 Space group: P 1 Cell volume: 541.2 Cell parameters: 9.227; 8.89; 7.219; 110.12; 102.68; 82.13;

COD ID: 1007208
CIF file	Formula: - H2 K7 N O22 P6 - Comments: Averbuch-Pouchot, M T; Durif, A Structural characterization of a series of cyclohexaphosphate nitrates: M~6~P~6~O~18~.MNO~3~.H~2~O. (M=K, NH~4~ and Rb) European Journal of Solid State Inorganic Chemistry 29 (1992) 1161-1172 Space group: P 1 Cell volume: 558.3 Cell parameters: 9.7; 9.749; 6.543; 107.23; 106.37; 75.88;

COD ID: 1010563
CIF file	Formula: - Al Cl3 - Comments: Laschkarew, W E Zur Struktur Al Cl~3~ Zeitschrift fuer Anorganische und Allgemeine Chemie 193 (1930) 270-276 Space group: P 1 Cell volume: 89 Cell parameters: 3.475; 3.475; 8.51; 90; 90; 120;

COD ID: 1100201
CIF file	Formula: - C14 H12 Cl2 O S - Comments: Hoffmann, Reinhard W.; Nell, Peter G.; Leo, Roland; Harms, Klaus Highly Enantiomerically Enriched α-Haloalkyl Grignard Reagents Chemistry - A European Journal 6(18) (2000) 3359-3365 Space group: P 1 Cell volume: 683.92 Cell parameters: 9.018; 9.6771; 9.974; 71.564; 62.985; 62.938;

COD ID: 1100202
CIF file	Formula: - C14 H12 Br Cl O S - Comments: Hoffmann, Reinhard W.; Nell, Peter G.; Leo, Roland; Harms, Klaus Highly Enantiomerically Enriched α-Haloalkyl Grignard Reagents Chemistry - A European Journal 6(18) (2000) 3359-3365 Space group: P 1 Cell volume: 699.198 Cell parameters: 9.1121; 9.7596; 9.9764; 84.681; 62.893; 63.397;

COD ID: 1100269
CIF file	Formula: - C54 H82 N9 O6.5 - Comments: Hoffmann, Reinhard W.; Hettche, Frank; Harms, Klaus Energies and selectivities for anion binding as a function of host conformational preorganisation Chemical Communications (Cambridge, United Kingdom) (issue 7) (2002) 782-783 Space group: P 1 Cell volume: 2782.6 Cell parameters: 9.3553; 15.9882; 19.585; 103.119; 90.298; 102.334;

COD ID: 1100342
CIF file	Formula: - C39 H52 B N O9 - Comments: Reetz, Manfred T.; Niemeyer, Christof M.; Harms, Klaus Heterotopic Host Molecules for Binding Two Different Guests Angewandte Chemie, International Edition in English 30(11) (1991) 1474-1476 Space group: P 1 Cell volume: 1919.53 Cell parameters: 10.938; 13.923; 14.477; 101.16; 109.52; 104.29;

COD ID: 1100404

CIF file

Formula: - C26 H27 Li O2 -
Comments: Dem'yanov, Piotr; Boche, Gernot; Marsch, Michael; Harms, Klaus; Fyodorova, Galina; Petrosyan, Valery Crystal Structure of η^3^-lithio-1,3,3-triphenylpropyne-(diethyl ether)~2~ and [1-lithio-1-(2-methoxyphenyl)-3,3-diphenylallene‒diethyl ether]~2~: Propargyl- versus allenyl-type structures Liebigs Annalen 1995(3) (1995) 457-460
Space group: P 1
Cell volume: 2192.74
Cell parameters: 11.05; 11.561; 19.302; 96.94; 93; 115.58;

COD ID: 1100503

CIF file

Formula: - C27 H25 N O2 -
Comments: Kossenjans, Michael; Soeberdt, Michael; Wallbaum, Sabine; Harms, Klaus; Martens, Jürgen; Aurich, Hans Günter Utilization of industrial waste materials. Part 14. Synthesis of β-amino alcohols and thiols with a 2-azabicyclo[3.3.0]octane backbone and their application in enantioselective catalysis Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999) (issue 16) (1999) 2353-2365
Space group: P 1
Cell volume: 1034.63
Cell parameters: 8.766; 9.673; 12.647; 81.71; 82.07; 78.91;

COD ID: 1100594

CIF file

Formula: - C36 H33 B V3 -
Comments: Elschenbroich, Christoph; Wolf, Matthias; Burghaus, Olaf; Harms, Klaus; Pebler, Jürgen The Mono-, Di-, and Tri([5]trovacenyl)boranes: A Study of Intermetallic Communication Across an sp^2^-Hybridized Boron Atom European Journal of Inorganic Chemistry 1999(12) (1999) 2173-2185
Space group: P 1
Cell volume: 1389.48
Cell parameters: 7.796; 12.429; 14.599; 98.94; 94.67; 93.15;

COD ID: 1100692
CIF file	Formula: - Bi2 K6 O21 P6 - Comments: Falah, Chiraz; Boughzala, Habib; Jouini, Tahar Preparation and the Crystal Structure of Non-centrosymmetric K~6~Bi~2~(P~2~O~7~)~3~ Analytical Sciences: X-ray Structure Analysis Online 20 (2004) x17-x18 Space group: P 1 Cell volume: 549.5 Cell parameters: 6.985; 9.045; 10.256; 111.87; 104.25; 102;

COD ID: 1100982

CIF file

Formula: - C52 H58 Co F6 N2 O2 Pd -
Comments: Swarnalatha Kokatam; Thomas Weyhermüller; Eberhard Bothe; Phalguni Chaudhuri; Karl Wieghardt Structural Characterization of Four Members of the Electron-Transfer Series [PdII(L)2)2]n (L = o-Iminophenolate Derivative; n= 2-, 1-, 0, 1+, 2+). Ligand Mixed Valency in the Monocation and Monoanion with S=1/2 Ground States Inorganic Chemistry 44 (2005) 3709-3717
Space group: P 1
Cell volume: 1177.57
Cell parameters: 10.1173; 10.4874; 12.6206; 67.012; 73.738; 88.769;

COD ID: 1101105
CIF file	Formula: - C20 H42 N8 Ni O22 - Comments: Francisca Barrios; Juan M. Salas; M. Purificación Sánchez; Miguel Quirós; René Faure X-ray crystal structure of tetraaquabis(xanthosinato) nickel(II) hexahydrate Journal of Chemical Crystallography 29 (1999) 1009-1013 Space group: P 1 Cell volume: 814.3 Cell parameters: 7.152; 8.83; 13.783; 82.024; 86.155; 70.9;

COD ID: 1101134
CIF file	Formula: - C15 H31.75 Cl0.88 K0.88 N3 O8.38 Pd3 S3 - Comments: G. Cervantes; V. Moreno; E. Molins; Miguel Quirós Pd(II) and Pt(II) D-penicillamine complexes. Crystal structure of a tridentate D-penicillamine cluster of Pd(II) Polyhedron 17 (1998) 3343-3350 Space group: P 1 Cell volume: 2853.7 Cell parameters: 11.076; 11.045; 24.728; 91.19; 94.5; 108.67;

COD ID: 1501804
CIF file	Formula: - C15 H23.5 O5 - Comments: Li, Guohong; Liu, Fangfang; Shen, Lan; Zhu, Huajie; Zhang, Keqin Stereumins H-J, stereumane-type sesquiterpenes from the fungus Stereum sp. Journal of natural products 74(2) (2011) 296-299 Space group: P 1 Cell volume: 774.5 Cell parameters: 8.583; 9.549; 11.107; 73.568; 69.697; 67.017;

COD ID: 1501831
CIF file	Formula: - C30 H46 O3 - Comments: Cheng, Shi-Yie; Wang, Chao-Min; Hsu, Yuan-Man; Huang, Tsurng-Juhn; Chou, Shen-Chieh; Lin, En-Hung; Chou, Chang-Hung Oleanane-type triterpenoids from the leaves and twigs of Fatsia polycarpa. Journal of natural products 74(8) (2011) 1744-1750 Space group: P 1 Cell volume: 618.86 Cell parameters: 6.7903; 7.0914; 14.7228; 78.885; 81.171; 63.15;

COD ID: 1501866
CIF file	Formula: - C24 H22 O2 S - Comments: Antczak, Monika I.; Cai, Feng; Ready, Joseph M. Asymmetric synthesis of tertiary benzylic alcohols. Organic letters 13(2) (2011) 184-187 Space group: P 1 Cell volume: 1029.9 Cell parameters: 8.351; 10.444; 13.019; 105.335; 97.845; 105.307;

COD ID: 1501923
CIF file	Formula: - C128 H112 Na2 O16 P2 Si4 - Comments: Hennecke, Ulrich; Müller, Christian H; Fröhlich, Roland Enantioselective haloetherification by asymmetric opening of meso-halonium ions. Organic letters 13(5) (2011) 860-863 Space group: P 1 Cell volume: 2802.94 Cell parameters: 14.2979; 14.5398; 15.7308; 71.49; 87.882; 65.423;

COD ID: 1501963

CIF file

Formula: - C24 H35 I2 N O5 -
Comments: Brock, E. Anne; Davies, Stephen G.; Lee, James A.; Roberts, Paul M.; Thomson, James E. Asymmetric synthesis of polyhydroxylated pyrrolizidines via transannular iodoamination with concomitant N-debenzylation. Organic letters 13(7) (2011) 1594-1597
Space group: P 1
Cell volume: 687.36
Cell parameters: 8.3429; 8.7613; 9.7629; 96.9997; 101.396; 96.5153;

COD ID: 1501997

CIF file

Formula: - C25 H28 O9 -
Comments: de Silva, E. Dilip; Williams, David E.; Jayanetti, Dinith R.; Centko, Ryan M.; Patrick, Brian O.; Wijesundera, Ravi L. C.; Andersen, Raymond J. Dhilirolides A-D, meroterpenoids produced in culture by the fruit-infecting fungus Penicillium purpurogenum collected in Sri Lanka. Organic letters 13(5) (2011) 1174-1177
Space group: P 1
Cell volume: 2191.1
Cell parameters: 13.5779; 13.641; 15.0542; 65.339; 65.488; 64.504;

COD ID: 1502069
CIF file	Formula: - C16 H27 N O4 S - Comments: Brichacek, Matthew; Villalobos, Mauricio Navarro; Plichta, Alexandra; Njardarson, Jon T. Stereospecific ring expansion of chiral vinyl aziridines. Organic letters 13(5) (2011) 1110-1113 Space group: P 1 Cell volume: 1318.66 Cell parameters: 7.2192; 11.2843; 17.5962; 104.861; 91.043; 106.942;

COD ID: 1502158

CIF file

Formula: - C24 H24 N2 O3 S2 -
Comments: Chen, Wen-Bing; Wu, Zhi-Jun; Hu, Jing; Cun, Lin-Feng; Zhang, Xiao-Mei; Yuan, Wei-Cheng Organocatalytic direct asymmetric aldol reactions of 3-isothiocyanato oxindoles to ketones: stereocontrolled synthesis of spirooxindoles bearing highly congested contiguous tetrasubstituted stereocenters. Organic letters 13(9) (2011) 2472-2475
Space group: P 1
Cell volume: 1171.33
Cell parameters: 9.8593; 11.3699; 11.6474; 67.803; 76.579; 89.515;

COD ID: 1502210
CIF file	Formula: - C56 H84 O8 - Comments: Bai, Xinyan; Barnes, Charles; Pascal, Jr, Robert A.; Chen, Xueyi; Dias, Jerry Ray Bile Acid-Based Cage Compounds with Lipophilic Outer Shells and Inner Cavities Organic Letters 13(12) (2011) 3064-3067 Space group: P 1 Cell volume: 2808.6 Cell parameters: 15.09; 15.095; 15.132; 96.611; 116.223; 108.05;

COD ID: 1502284
CIF file	Formula: - C27 H26 Br Cl3 N2 O2 - Comments: Jensen, Kim L.; Dickmeiss, Gustav; Donslund, Bjarke S.; Poulsen, Pernille H.; Jørgensen, Karl Anker Asymmetric organocatalytic synthesis of complex cyclopenta[b]quinoline derivatives. Organic letters 13(14) (2011) 3678-3681 Space group: P 1 Cell volume: 1303.38 Cell parameters: 9.9605; 11.4468; 13.0628; 111.413; 100.86; 101.302;

COD ID: 1502295

CIF file

Formula: - C24 H31 N2 O6.5 -
Comments: Zhao, Bing-Xin; Wang, Ying; Zhang, Dong-Mei; Jiang, Ren-Wang; Wang, Guo-Cai; Shi, Jun-Min; Huang, Xiao-Jun; Chen, Wei-Min; Che, Chun-Tao; Ye, Wen-Cai Flueggines A and B, Two New Dimeric Indolizidine Alkaloids from Flueggea virosa Organic Letters 13(15) (2011) 3888-3891
Space group: P 1
Cell volume: 1098.97
Cell parameters: 7.4783; 11.5713; 13.3812; 107.895; 90.072; 93.959;

COD ID: 1502401

CIF file

Formula: - C38 H41 N3 O7 -
Comments: Zhang, Zhihui; Baubet, Valérie; Ventocilla, Christian; Xiang, Chaomei; Dahmane, Nadia; Winkler, Jeffrey D. Stereoselective synthesis of F-ring saturated estrone-derived inhibitors of Hedgehog signaling based on cyclopamine. Organic letters 13(18) (2011) 4786-4789
Space group: P 1
Cell volume: 1651.72
Cell parameters: 7.1374; 10.4915; 23.5245; 96.57; 91.75; 108.864;

COD ID: 1502447
CIF file	Formula: - C23 H28 N O3 P - Comments: DeKorver, Kyle A.; Walton, Mary C.; North, Troy D.; Hsung, Richard P. Introducing a new class of N-phosphoryl ynamides via Cu(I)-catalyzed amidations of alkynyl bromides. Organic letters 13(18) (2011) 4862-4865 Space group: P 1 Cell volume: 526.49 Cell parameters: 5.8722; 9.695; 9.999; 109.909; 93.647; 97.854;

COD ID: 1502505
CIF file	Formula: - C28 H26 Br2 N4 O3 - Comments: Wanner, Benedikt; Mahatthananchai, Jessada; Bode, Jeffrey W. Enantioselective synthesis of dihydropyridinones via NHC-catalyzed aza-Claisen reaction. Organic letters 13(19) (2011) 5378-5381 Space group: P 1 Cell volume: 1307.17 Cell parameters: 7.7053; 13.2135; 13.4615; 76.246; 84.746; 79.465;

COD ID: 1502565
CIF file	Formula: - C30 H30 Cl N O6 S - Comments: Zhou, Si-Li; Li, Jun-Long; Dong, Lin; Chen, Ying-Chun Organocatalytic sequential hetero-Diels-Alder and Friedel-Crafts reaction: constructions of fused heterocycles with scaffold diversity. Organic letters 13(21) (2011) 5874-5877 Space group: P 1 Cell volume: 711.9 Cell parameters: 8.185; 9.222; 10.247; 69.237; 80.106; 84.347;

COD ID: 1502593
CIF file	Formula: - C16 H12 N2 O3 S - Comments: Wang, Xiao-Na; Shen, Li-Tao; Ye, Song NHC-catalyzed enantioselective [2 + 2] and [2 + 2 + 2] cycloadditions of ketenes with isothiocyanates. Organic letters 13(24) (2011) 6382-6385 Space group: P 1 Cell volume: 1448.1 Cell parameters: 8.327; 11.225; 16.443; 108.255; 96.36; 91.162;

COD ID: 1502718

CIF file

Formula: - C98.7 H140 O96.95 -
Comments: Guerrero-Martínez, Andrés; Avila, David; Martínez-Casado, Francisco J; Ripmeester, John A.; Enright, Gary D.; De Cola, Luisa; Tardajos, Gloria Solid crystal network of self-assembled cyclodextrin and nonionic surfactant pseudorotaxanes. The journal of physical chemistry. B 114(35) (2010) 11489-11495
Space group: P 1
Cell volume: 3380.1
Cell parameters: 15.419; 15.464; 15.612; 102.72; 102.012; 104.309;

COD ID: 1502819

CIF file

Formula: - C15 H22 O3 -
Comments: Pettit, George R.; Meng, Yanhui; Pettit, Robin K.; Herald, Delbert L.; Cichacz, Zbigniew A.; Doubek, Dennis L.; Richert, Linda Antineoplastic agents. 556. Isolation and structure of Coprinastatin 1 from Coprinus cinereus. Journal of natural products 73(3) (2010) 388-392
Space group: P 1
Cell volume: 345.964
Cell parameters: 6.7943; 6.0697; 8.6532; 90.358; 104.185; 90.069;

COD ID: 1502950
CIF file	Formula: - C85 H112 Cl3 F12 N5 O21 P2 - Comments: Su, Yong-Sheng; Chen, Chuan-Feng Novel anthracene-based cylindrical macrotricyclic polyether: powerful host for bispyridinium dications. Organic letters 12(8) (2010) 1888-1891 Space group: P 1 Cell volume: 2457.6 Cell parameters: 10.5785; 12.5308; 20.433; 97.683; 97.63; 111.007;

COD ID: 1503104

CIF file

Formula: - C19 H20 O4 -
Comments: Yang, Chun-Ming; Jeganmohan, Masilamani; Parthasarathy, Kanniyappan; Cheng, Chien-Hong Highly selective nickel-catalyzed three-component coupling of alkynes with enones and alkenyl boronic acids: a novel route to substituted 1,3-dienes Organic Letters 12(16) (2010) 3610-3613
Space group: P 1
Cell volume: 399.308
Cell parameters: 5.3565; 7.6392; 10.099; 76.068; 85.27; 86.338;

COD ID: 1503122
CIF file	Formula: - C84 H151 N13 O22 - Comments: Nagano, Masanobu; Doi, Mitsunobu; Kurihara, Masaaki; Suemune, Hiroshi; Tanaka, Masakazu Stabilized alpha-helix-catalyzed enantioselective epoxidation of alpha,beta-unsaturated ketones. Organic letters 12(15) (2010) 3564-3566 Space group: P 1 Cell volume: 2482.8 Cell parameters: 11.2535; 11.6895; 19.1693; 86.46; 80.779; 87.428;

COD ID: 1503156
CIF file	Formula: - C43 H44 Cl2 N4 Ni O4 - Comments: Dong, Zhenzhen; Plampin, 3rd, James N; Yap, Glenn P. A.; Fox, Joseph M. Minimalist end groups for control of absolute helicity in salen- and salophen-based metallofoldamers. Organic letters 12(18) (2010) 4002-4005 Space group: P 1 Cell volume: 1895.9 Cell parameters: 12.3092; 12.3128; 12.973; 90.061; 102.664; 98.557;

COD ID: 1503196

CIF file

Formula: - C26 H24 O8 -
Comments: Sakamoto, Masami; Yagishita, Fumitoshi; Kanehiro, Masayuki; Kasashima, Yoshio; Mino, Takashi; Fujita, Tsutomu Exclusive photodimerization reactions of chromone-2-carboxylic esters depending on reaction media. Organic letters 12(20) (2010) 4435-4437
Space group: P 1
Cell volume: 578.64
Cell parameters: 6.5748; 8.8652; 10.7627; 69.163; 82.406; 82.35;

COD ID: 1503261
CIF file	Formula: - C26 H34 Cl4 N O P Pd - Comments: Dugal-Tessier, Julien; Dake, Gregory R.; Gates, Derek P. Chiral phosphaalkene-oxazoline ligands for the palladium-catalyzed asymmetric allylic alkylation. Organic letters 12(20) (2010) 4667-4669 Space group: P 1 Cell volume: 718.9 Cell parameters: 8.428; 8.919; 9.803; 93.261; 100.551; 95.576;

COD ID: 1503271

CIF file

Formula: - C26 H22 Cl4 N3 O2 -
Comments: Tetlow, Daniel J.; Hennecke, Ulrich; Raftery, James; Waring, Michael J.; Clarke, David S.; Clayden, Jonathan Sequential double α-arylation of N-allylureas by asymmetric deprotonation and N→C aryl migration. Organic letters 12(23) (2010) 5442-5445
Space group: P 1
Cell volume: 1302.3
Cell parameters: 10.006; 11.099; 11.923; 80.594; 85.493; 89.428;

COD ID: 1503313
CIF file	Formula: - C8 H16 N2 O4 S2 - Comments: Wang, Yazhou; Hu, Xichao; Du, Haifeng Vicinal-diamine-based chiral chain dienes as ligands for rhodium(I)-catalyzed highly enantioselective conjugated additions. Organic letters 12(23) (2010) 5482-5485 Space group: P 1 Cell volume: 632.6 Cell parameters: 8.089; 9.221; 9.805; 70.49; 68.96; 73.73;

COD ID: 1503416
CIF file	Formula: - C77 H81 F24 N9 O12 P4 - Comments: Liu, Ming; Li, Shijun; Hu, Menglong; Wang, Feng; Huang, Feihe Selectivity algorithm for the formation of two cryptand/paraquat catenanes. Organic letters 12(4) (2010) 760-763 Space group: P 1 Cell volume: 2053.8 Cell parameters: 13.474; 13.507; 14.013; 103.97; 99.34; 118.61;

COD ID: 1503456
CIF file	Formula: - C155 H176 N4 O9 - Comments: Gibson, Harry W.; Wang, Hong; Niu, Zhenbin; Slebodnick, Carla; Zhakharov, Lev N.; Rheingold, Arnold L. Rotaxanes from Tetralactams Macromolecules 45(3) (2012) 1270 Space group: P 1 Cell volume: 3656.4 Cell parameters: 11.6351; 16.2914; 20.4165; 75.588; 87.355; 77.305;

COD ID: 1503465

CIF file

Formula: - C16 H18 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: P 1
Cell volume: 685.8
Cell parameters: 7.7085; 9.851; 10.445; 80.9; 69.55; 67.39;

COD ID: 1503483

CIF file

Formula: - C55 H46 N10 -
Comments: Chiu, Melanie; Jaun, Bernhard; Beels, Marten T. R.; Biaggio, Ivan; Gisselbrecht, Jean-Paul; Boudon, Corinne; Schweizer, W. Bernd; Kivala, Milan; Diederich, François N,N'-Dicyanoquinone diimide-derived donor-acceptor chromophores: conformational analysis and optoelectronic properties. Organic letters 14(1) (2012) 54-57
Space group: P 1
Cell volume: 1102.8
Cell parameters: 7.2402; 11.587; 13.95; 89.683; 78.116; 74.635;

COD ID: 1503600
CIF file	Formula: - C23 H23 I N2 O8 - Comments: Shan, Mingde; Kishi, Yoshito Concise and highly stereoselective synthesis of the C20-C26 building block of halichondrins and Eribulin Organic Letters 14(2) (2012) 660-663 Space group: P 1 Cell volume: 1204.27 Cell parameters: 7.9894; 11.0136; 14.6649; 90.994; 105.668; 103.389;

COD ID: 1503631
CIF file	Formula: - C28 H32 Cl2 N2 O8 - Comments: Gonella, Silvia; Mahieux, Julien; Sanselme, Morgane; Coquerel, Gérard Spotting a Conglomerate Is Just Halfway to Achieving a Preparative Resolution by Preferential Crystallization Organic Process Research & Development 16(2) (2012) 286 Space group: P 1 Cell volume: 723.6 Cell parameters: 5.7819; 9.6587; 13.317; 79.109; 82.475; 86.782;

COD ID: 1503636
CIF file	Formula: - C18 H24 N2 O2 - Comments: Mei, Luo; Hai, Zhang Jia; Jie, Sun; Ming, Zhou Shi; Hao, Yin; Liang, Hu Ke Modular synthesis of oxazolines and their derivatives. Journal of combinatorial chemistry 11(2) (2009) 220-227 Space group: P 1 Cell volume: 850.8 Cell parameters: 5.8138; 9.773; 15.314; 84.585; 88.44; 79.196;

COD ID: 1503677
CIF file	Formula: - C17 H17 N O6 - Comments: Cedrón, Juan C; Oberti, Juan C.; Estévez-Braun, Ana; Ravelo, Angel G.; Del Arco-Aguilar, Marcelino; López, Matías Pancratium canariense as an important source of amaryllidaceae alkaloids. Journal of natural products 72(1) (2009) 112-116 Space group: P 1 Cell volume: 753.4 Cell parameters: 8.163; 8.22; 11.652; 100.21; 101.26; 91.22;

COD ID: 1503685
CIF file	Formula: - C36 H54 N2 O6 - Comments: Yan, Yu-Xin; Hu, Xiao-Dong; Chen, Jian-Chao; Sun, Yun; Zhang, Xian-Min; Qing, Chen; Qiu, Ming-Hua Cytotoxic triterpenoid alkaloids from Buxus microphylla. Journal of natural products 72(2) (2009) 308-311 Space group: P 1 Cell volume: 843.2 Cell parameters: 6.778; 7.8277; 16.835; 81.293; 87.547; 72.743;

COD ID: 1503692
CIF file	Formula: - C31 H46 O5 - Comments: Nuanyai, Thanesuan; Sappapan, Reungrit; Teerawatananond, Thapong; Muangsin, Nongnuj; Pudhom, Khanitha Cytotoxic 3,4-seco-cycloartane triterpenes from Gardenia sootepensis. Journal of natural products 72(6) (2009) 1161-1164 Space group: P 1 Cell volume: 698.77 Cell parameters: 7.3556; 7.4296; 14.2899; 81.762; 82.937; 65.002;

COD ID: 1503694
CIF file	Formula: - C30 H48 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: P 1 Cell volume: 664.71 Cell parameters: 6.943; 7.2493; 15.2539; 81.411; 80.394; 61.762;

COD ID: 1503784
CIF file	Formula: - C56.25 H50.5 Cl1.5 N5 O19.5 - Comments: Legouin, Béatrice; Uriac, Philippe; Tomasi, Sophie; Toupet, Loïc; Bondon, Arnaud; van de Weghe, Pierre Novel chiral molecular tweezer from (+)-usnic acid Organic letters 11(3) (2009) 745-748 Space group: P 1 Cell volume: 2631 Cell parameters: 12.936; 13.306; 15.561; 98.33; 96.83; 89.96;

COD ID: 1503793
CIF file Original IUCr paper	Formula: - C12 H21 N O - Comments: Guéret, Stéphanie M; O'Connor, Patrick D; Brimble, Margaret A. Synthesis of enantiopure bicyclic alpha,alpha-disubstituted spirolactams via asymmetric Birch reductive alkylation. Organic letters 11(4) (2009) 963-966 Space group: P 1 Cell volume: 1081.78 Cell parameters: 8.5417; 10.2807; 12.64; 102.85; 90.091; 91.488;

COD ID: 1503799
CIF file	Formula: - C54 H80 N6 O16 - Comments: Nagano, Masanobu; Tanaka, Masakazu; Doi, Mitsunobu; Demizu, Yosuke; Kurihara, Masaaki; Suemune, Hiroshi Helical-screw directions of diastereoisomeric cyclic alpha-amino acid oligomers. Organic letters 11(5) (2009) 1135-1137 Space group: P 1 Cell volume: 2814 Cell parameters: 13.96; 14.59; 15.59; 115.43; 94.94; 96.77;

COD ID: 1503802
CIF file	Formula: - C65 H101 N8 O20.5 - Comments: Nagano, Masanobu; Tanaka, Masakazu; Doi, Mitsunobu; Demizu, Yosuke; Kurihara, Masaaki; Suemune, Hiroshi Helical-screw directions of diastereoisomeric cyclic alpha-amino acid oligomers. Organic letters 11(5) (2009) 1135-1137 Space group: P 1 Cell volume: 3380 Cell parameters: 9.995; 17.515; 20.382; 71.492; 87.501; 89.647;

COD ID: 1504038
CIF file	Formula: - C8 H6 Cl I - Comments: Pawluć, Piotr; Hreczycho, Grzegorz; Szudkowska, Justyna; Kubicki, Maciej; Marciniec, Bogdan New one-pot synthesis of (E)-beta-aryl vinyl halides from styrenes. Organic letters 11(15) (2009) 3390-3393 Space group: P 1 Cell volume: 866.5 Cell parameters: 7.352; 7.365; 16.241; 91.31; 91.52; 99.58;

COD ID: 1504218
CIF file	Formula: - C26 H21 O3 - Comments: Yoshida, Masahiro; Higuchi, Mariko; Shishido, Kozo Stereoselective construction of substituted chromans by palladium-catalyzed cyclization of propargylic carbonates with 2-(2-hydroxyphenyl)acetates. Organic letters 11(20) (2009) 4752-4755 Space group: P 1 Cell volume: 1007.26 Cell parameters: 8.4452; 10.6647; 11.566; 82.23; 89.149; 77.425;

COD ID: 1504219
CIF file	Formula: - C26 H33 N O3 Si - Comments: Tietze, Lutz F.; Tölle, Nina; Kratzert, Daniel; Stalke, Dietmar Efficient formal total synthesis of the erythrina alkaloid (+)-erysotramidine, using a domino process. Organic letters 11(22) (2009) 5230-5233 Space group: P 1 Cell volume: 1184.9 Cell parameters: 7.718; 11.898; 14.296; 96.932; 103.456; 108.338;

COD ID: 1504515

CIF file

Formula: - C168 H191 N22 Zn2 -
Comments: Maeda, Chihiro; Yamaguchi, Shigeru; Ikeda, Chusaku; Shinokubo, Hiroshi; Osuka, Atsuhiro Dimeric assemblies from 1,2,3-triazole-appended Zn(II) porphyrins with control of NH-tautomerism in 1,2,3-triazole. Organic letters 10(4) (2008) 549-552
Space group: P 1
Cell volume: 3716.5
Cell parameters: 13.1202; 16.6253; 17.5706; 78.601; 81.694; 89.735;

COD ID: 1504532
CIF file	Formula: - C27 H41 N O8 S - Comments: Hjelmgaard, Thomas; Faure, Sophie; Lemoine, Pascale; Viossat, Bernard; Aitken, David J. Rapid assembly of the polyhydroxylated beta-amino acid constituents of microsclerodermins C, D, and E. Organic letters 10(5) (2008) 841-844 Space group: P 1 Cell volume: 733.44 Cell parameters: 6.186; 9.556; 13.169; 91.968; 99.625; 106.425;

COD ID: 1504538
CIF file	Formula: - C22 H28 N4 - Comments: Zhao, Baoguo; Du, Haifeng; Shi, Yian Cu(I)-catalyzed cycloguanidination of olefins. Organic letters 10(6) (2008) 1087-1090 Space group: P 1 Cell volume: 1021.72 Cell parameters: 8.854; 10.1088; 11.9207; 105.763; 90.439; 95.36;

COD ID: 1504587

CIF file

Formula: - C13 H15 N O3 -
Comments: Garrido, Narciso M.; García, Mercedes; Díez, David; Sánchez, M Rosa; Sanz, F.; Urones, Julio G. Diastereoselective synthesis of delta-aminoacids through domino Ireland-Claisen rearrangement and Michael addition. Organic letters 10(9) (2008) 1687-1690
Space group: P 1
Cell volume: 623.2
Cell parameters: 5.731; 9.956; 11.765; 106.35; 96.43; 100.74;

COD ID: 1504597
CIF file	Formula: - C37 H39 F3 N4 O7 S - Comments: Hu, Hai-Yu; Xiang, Jun-Feng; Yang, Yong; Chen, Chuan-Feng Chiral induction in phenanthroline-derived oligoamide foldamers: an acid- and base-controllable switch in helical molecular strands. Organic letters 10(6) (2008) 1275-1278 Space group: P 1 Cell volume: 1872.7 Cell parameters: 11.593; 11.938; 14.843; 103.82; 93.69; 108.25;

COD ID: 1504754

CIF file

Formula: - C27 H26 N O2 P -
Comments: Oña-Burgos, Pascual; Fernández, Ignacio; Roces, Laura; Torre-Fernández, Laura; García-Granda, Santiago; López-Ortiz, Fernando Asymmetric deprotonation-substitution of N-Pop-benzylamines using [RLi/(-)-sparteine]. Enantioselective sequential reactions and synthesis of N-heterocycles. Organic letters 10(15) (2008) 3195-3198
Space group: P 1
Cell volume: 1123.29
Cell parameters: 9.9856; 10.1967; 11.5731; 100.869; 103.617; 90.203;

COD ID: 1504759
CIF file	Formula: - C22 H19 O2 P - Comments: Cullen, Steven C.; Rovis, Tomislav Catalytic asymmetric stetter reaction onto vinylphosphine oxides and vinylphosphonates. Organic letters 10(14) (2008) 3141-3144 Space group: P 1 Cell volume: 912.1 Cell parameters: 9.3998; 9.9414; 11.4269; 65.82; 74.446; 71.54;

COD ID: 1504791
CIF file	Formula: - C20 H28 O2 - Comments: Boukouvalas, John; Wang, Jian-Xin Structure revision and synthesis of a novel labdane diterpenoid from Zingiber ottensii. Organic letters 10(16) (2008) 3397-3399 Space group: P 1 Cell volume: 853.61 Cell parameters: 6.3335; 7.2872; 20.5729; 91.2787; 97.7238; 114.408;

COD ID: 1504817

CIF file

Formula: - C49 H52 N4 O9 -
Comments: Kam, Toh-Seok; Tan, Shin-Jowl; Ng, Seik-Weng; Komiyama, Kanki Bipleiophylline, an unprecedented cytotoxic bisindole alkaloid constituted from the bridging of two indole moieties by an aromatic spacer unit. Organic letters 10(17) (2008) 3749-3752
Space group: P 1
Cell volume: 1062.55
Cell parameters: 9.1602; 9.9973; 12.4147; 79.119; 81.756; 72.924;

COD ID: 1504904

CIF file

Formula: - C18 H24 N4 O8 -
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: P 1
Cell volume: 999.41
Cell parameters: 7.2898; 9.3886; 15.9051; 91.007; 97.177; 111.934;

COD ID: 1504906

CIF file

Formula: - C24 H27 N5 O9 -
Comments: Zhu, Di; Lu, Min; Chua, Pei Juan; Tan, Bin; Wang, Fei; Yang, Xinhao; Zhong, Guofu A highly stereoselective organocatalytic tandem aminoxylation/aza-Michael reaction for the synthesis of tetrahydro-1,2-oxazines. Organic letters 10(20) (2008) 4585-4588
Space group: P 1
Cell volume: 2523.68
Cell parameters: 10.8521; 11.1482; 21.2318; 82.573; 86.637; 82.618;

COD ID: 1505032

CIF file

Formula: - C30 H48 N2 O3 -
Comments: Sauvaître, Thibault; Barlier, Mireille; Herlem, Denyse; Gresh, Nohad; Chiaroni, Angèle; Guenard, Daniel; Guillou, Catherine New potent acetylcholinesterase inhibitors in the tetracyclic triterpene series. Journal of medicinal chemistry 50(22) (2007) 5311-5323
Space group: P 1
Cell volume: 695.6
Cell parameters: 6.135; 6.77; 17.17; 92.3; 97.87; 99.35;

COD ID: 1505221
CIF file	Formula: - C50 H88 Cl6 O15 - Comments: Wagenaar, Melissa M.; Williamson, R. Thomas; Ho, Douglas M.; Carter, Guy T. Structure and absolute stereochemistry of 21-hydroxyoligomycin A. Journal of natural products 70(3) (2007) 367-371 Space group: P 1 Cell volume: 1568.77 Cell parameters: 10.0874; 12.5229; 13.6632; 65.648; 88.15; 86.102;

COD ID: 1505341
CIF file	Formula: - C9 H18 N2 O3 - Comments: Guha, Samit; Drew, Michael G. B.; Banerjee, Arindam A new molecular scaffold for the formation of supramolecular peptide double helices: the crystallographic insight. Organic letters 9(7) (2007) 1347-1350 Space group: P 1 Cell volume: 1101.1 Cell parameters: 12.5522; 5.516; 15.9248; 89.816; 87.074; 89.234;

COD ID: 1505512

CIF file

Formula: - C60 H60 N2 O9 -
Comments: Imai, Yoshitane; Murata, Katuzo; Kawaguchi, Kakuhiro; Sato, Tomohiro; Kuroda, Reiko; Matsubara, Yoshio A solid-state fluorescence sensing system consisting of chiral (1R,2S)-2-amino-1,2-diphenylethanol and fluorescent 2-anthracenecarboxylic acid. Organic letters 9(17) (2007) 3457-3460
Space group: P 1
Cell volume: 1217.32
Cell parameters: 5.7753; 14.7522; 16.0657; 116.528; 91.539; 94.751;

COD ID: 1505617
CIF file	Formula: - C16 H14 Br2 S2 - Comments: Tanaka, Ken; Hori, Tomoko; Osaka, Takuya; Noguchi, Keiichi; Hirano, Masao Rhodium-catalyzed reactions of dithiols and 1,4-bis(bromomethyl)benzenes leading to enantioenriched dithiaparacyclophanes. Organic letters 9(23) (2007) 4881-4884 Space group: P 1 Cell volume: 772 Cell parameters: 6.8118; 9.889; 12.2513; 91.288; 105.065; 103.457;

COD ID: 1505674
CIF file	Formula: - C17 H21 N O6 - Comments: Gerhardt, Warren W.; Noga, David E.; Hardcastle, Kenneth I.; García, Andrés J; Collard, David M.; Weck, Marcus Functional lactide monomers: methodology and polymerization. Biomacromolecules 7(6) (2006) 1735-1742 Space group: P 1 Cell volume: 851.9 Cell parameters: 4.95; 5.1931; 33.2; 91.997; 92.826; 90.042;

COD ID: 1505780
CIF file	Formula: - C22 H28 Br2 N4 O2 Zn - Comments: Chen, Hsuan-Ying; Tang, Hui-Yi; Lin, Chu-Chieh Ring-Opening Polymerization of Lactides Initiated by Zinc Alkoxides Derived from NNO-Tridentate Ligands Macromolecules 39(11) (2006) 3745-3752 Space group: P 1 Cell volume: 1194.67 Cell parameters: 9.2428; 11.5764; 11.4434; 89.98; 102.657; 89.997;

COD ID: 1505803

CIF file

Formula: - C36 H38 N2 O10 -
Comments: Quang, Dang Ngoc; Stadler, Marc; Fournier, Jacques; Asakawa, Yoshinori Carneic acids A and B, chemotaxonomically significant antimicrobial agents from the xylariaceous ascomycete Hypoxylon carneum. Journal of natural products 69(8) (2006) 1198-1202
Space group: P 1
Cell volume: 1677.32
Cell parameters: 6.564; 15.654; 16.701; 94.618; 92.568; 100.754;

COD ID: 1505916
CIF file	Formula: - C25 H24 Br N O3 - Comments: Smith, 3rd, Amos B; Davulcu, Akin H.; Kürti, Laszló Indole diterpenoid synthetic studies. Construction of the heptacyclic core of (-)-nodulisporic acid D. Organic letters 8(8) (2006) 1669-1672 Space group: P 1 Cell volume: 1078.26 Cell parameters: 6.1276; 12.1417; 15.6434; 109.99; 95.395; 95.643;

COD ID: 1505955
CIF file	Formula: - C54 H67 N2 O10 P S2 - Comments: Wünnemann, Stefan; Fröhlich, Roland; Hoppe, Dieter 3,3'-oxazolidinyl-substituted 2,2'-biphenyldiols: novel tropos ligands with a large induction on the chiral axis. Organic letters 8(12) (2006) 2455-2458 Space group: P 1 Cell volume: 1312.5 Cell parameters: 8.793; 10.789; 16.09; 109.16; 90.96; 112.66;

COD ID: 1506098
CIF file	Formula: - C44 H72 O16 - Comments: Smith, 3rd, Amos B; Simov, Vladimir Total synthesis of the marine natural product (-)-clavosolide A. A showcase for the Petasis-Ferrier union/rearrangement tactic. Organic letters 8(15) (2006) 3315-3318 Space group: P 1 Cell volume: 1196.1 Cell parameters: 8.9947; 10.8105; 13.9124; 81.632; 73.88; 67.096;

COD ID: 1506107

CIF file

Formula: - C19 H24 N2 O2 -
Comments: Evans, David A.; Song, Hyun-Ji; Fandrick, Keith R. Enantioselective nitrone cycloadditions of alpha,beta-unsaturated 2-acyl imidazoles catalyzed by bis(oxazolinyl)pyridine-cerium(IV) triflate complexes. Organic letters 8(15) (2006) 3351-3354
Space group: P 1
Cell volume: 887
Cell parameters: 9.6027; 10.0645; 11.093; 110.209; 109.26; 101.701;

COD ID: 1506323

CIF file

Formula: - C56 H78 Cl4 Cu2 N18 O21 -
Comments: Rasappan, Ramesh; Hager, Markus; Gissibl, Anja; Reiser, Oliver Highly enantioselective michael additions of indole to benzylidene malonate using simple bis(oxazoline) ligands: importance of metal/ligand ratio. Organic letters 8(26) (2006) 6099-6102
Space group: P 1
Cell volume: 1919.4
Cell parameters: 12.0986; 12.7138; 13.3209; 77.309; 81.44; 74.732;

COD ID: 1506352

CIF file

Formula: - C28 H38 N O6 P -
Comments: Albert, Rainer; Hinterding, Klaus; Brinkmann, Volker; Guerini, Danilo; Müller-Hartwieg, Constanze; Knecht, Helmut; Simeon, Corinne; Streiff, Markus; Wagner, Trixie; Welzenbach, Karl; Zécri, Frédéric; Zollinger, Markus; Cooke, Nigel; Francotte, Eric Novel immunomodulator FTY720 is phosphorylated in rats and humans to form a single stereoisomer. Identification, chemical proof, and biological characterization of the biologically active species and its enantiomer. Journal of medicinal chemistry 48(16) (2005) 5373-5377
Space group: P 1
Cell volume: 1385.1
Cell parameters: 6.413; 13.141; 17.092; 82.02; 86.3; 76.29;

COD ID: 1507002
CIF file	Formula: - C16 H28 N2 O5 S - Comments: Schenkel, Laurie B.; Ellman, Jonathan A. Self-condensation of N-tert-butanesulfinyl aldimines: application to the rapid asymmetric synthesis of biologically important amine-containing compounds. Organic letters 6(20) (2004) 3621-3624 Space group: P 1 Cell volume: 470.44 Cell parameters: 6.1035; 8.9701; 9.7458; 117.015; 93.643; 94.915;

COD ID: 1507079
CIF file	Formula: - C124 H104 B2 F48 Ir2 N2 O4 P2 - Comments: Smidt, Sebastian P.; Menges, Frederik; Pfaltz, Andreas SimplePHOX, a readily available chiral ligand system for iridium-catalyzed asymmetric hydrogenation. Organic letters 6(12) (2004) 2023-2026 Space group: P 1 Cell volume: 3113.94 Cell parameters: 12.8996; 12.9357; 22.1831; 105.044; 92.7318; 117.366;

COD ID: 1507080
CIF file	Formula: - C123 H101 B2 Cl3 F48 Ir2 N2 O4 P2 - Comments: Smidt, Sebastian P.; Menges, Frederik; Pfaltz, Andreas SimplePHOX, a readily available chiral ligand system for iridium-catalyzed asymmetric hydrogenation. Organic letters 6(12) (2004) 2023-2026 Space group: P 1 Cell volume: 3225.32 Cell parameters: 12.7425; 12.992; 23.0228; 87.9035; 74.6505; 61.9161;

COD ID: 1507084

CIF file

Formula: - C17 H16 N2 O -
Comments: Sakurai, Rumiko; Suzuki, Shuji; Hashimoto, Junichi; Baba, Manabu; Itoh, Osamu; Uchida, Akira; Hattori, Tetsutaro; Miyano, Sotaro; Yamaura, Masanori Epimerization of diastereomeric alpha-amino nitriles to single stereoisomers in the solid state. Organic letters 6(13) (2004) 2241-2244
Space group: P 1
Cell volume: 336.98
Cell parameters: 5.7296; 11.8879; 5.0674; 100.472; 92.263; 83.228;

COD ID: 1507221

CIF file

Formula: - C21 H35 N7 O18 P2 -
Comments: Guillot, Benoît; Muzet, Nicolas; Artacho, Emilio; Lecomte, Claude; Jelsch, Christian Experimental and Theoretical Electron Density Studies in Large Molecules: NAD+, β-Nicotinamide Adenine Dinucleotide The Journal of Physical Chemistry B 107(34) (2003) 9109
Space group: P 1
Cell volume: 773.7
Cell parameters: 8.592; 8.845; 11.192; 109.64; 90.56; 103.92;

COD ID: 1507260
CIF file	Formula: - C25 H34 O3 - Comments: Demeke, Damtew; Forsyth, Craig J. Total synthesis and stereochemistry of (-)-cacospongionolide F. Organic letters 5(7) (2003) 991-994 Space group: P 1 Cell volume: 543.2 Cell parameters: 6.2563; 6.9299; 13.824; 80.507; 77.19; 68.994;

COD ID: 1507322
CIF file	Formula: - C18 H28 O6 - 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: P 1 Cell volume: 948.7 Cell parameters: 8.2496; 10.1013; 11.6656; 82.558; 82.658; 82.064;

COD ID: 1507387

CIF file

Formula: - C28 H26 N2 O3 S -
Comments: Jang, Doo Ok; Kim, Dwight D.; Pyun, Do Kyu; Beak, Peter Synthesis of highly enantioenriched all-carbon quaternary centers: conjugate additions of chiral organolithium nucleophiles to alpha,alpha-dinitrile beta,beta-disubstituted olefins. Organic letters 5(22) (2003) 4155-4157
Space group: P 1
Cell volume: 1195.8
Cell parameters: 8.058; 10.51; 15.705; 72.19; 76.159; 73.244;

COD ID: 1507393

CIF file

Formula: - C21 H24 O8 S2 -
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: P 1
Cell volume: 569.6
Cell parameters: 5.408; 8.242; 13.494; 96.4; 97.35; 104.99;

COD ID: 1507487
CIF file	Formula: - C44 H36 Cl10 Fe2 N4 O S6 - Comments: Kozaki, M.; Yonezawa, Y.; Okada, K. Cyclopentadithiophene (CPDT) dimer dication: bipolaron model for quaterthiophenes. Organic letters 4(25) (2002) 4535-4538 Space group: P 1 Cell volume: 2916 Cell parameters: 13.844; 13.846; 18.7; 71.71; 71.68; 60.87;

COD ID: 1507624

CIF file

Formula: - C30 H24 Br N O3 S -
Comments: Hao, Lin; Du, Yu; Lv, Hui; Chen, Xingkuan; Jiang, Huishen; Shao, Yaling; Chi, Yonggui Robin Enantioselective Activation of Stable Carboxylate Esters as Enolate Equivalents via N-Heterocyclic Carbene Catalysts. Organic letters 14(8) (2012) 2154-2157
Space group: P 1
Cell volume: 1221.46
Cell parameters: 10.4778; 10.5926; 12.6565; 66.666; 75.97; 73.169;

COD ID: 1507712
CIF file	Formula: - C16 H16 N2 O S2 - Comments: Schönherr, Heike; Leighton, James L. Direct and highly enantioselective iso-Pictet-Spengler reactions with α-ketoamides: access to underexplored indole core structures. Organic letters 14(10) (2012) 2610-2613 Space group: P 1 Cell volume: 1500.6 Cell parameters: 8.3985; 11.9291; 15.318; 101.135; 94.64; 90.106;

COD ID: 1507748

CIF file

Formula: - C27 H28 Br N O6 -
Comments: Yang, Limin; Wang, Fei; Chua, Pei Juan; Lv, Yunbo; Zhong, Liang-Jun; Zhong, Guofu N-Heterocyclic Carbene (NHC)-Catalyzed Highly Diastereo- and Enantioselective Oxo-Diels-Alder Reactions for Synthesis of Fused Pyrano[2,3-b]indoles. Organic letters 14(11) (2012) 2894-2897
Space group: P 1
Cell volume: 629.88
Cell parameters: 5.036; 10.9704; 11.4714; 89.596; 84.698; 86.513;

COD ID: 1507994
CIF file	Formula: - C26 H29 B2 Br N2 O4 - Comments: Lee, Jack Chang Hung; McDonald, Robert; Hall, Dennis G. Enantioselective preparation and chemoselective cross-coupling of 1,1-diboron compounds. Nature chemistry 3(11) (2011) 894-899 Space group: P 1 Cell volume: 1286.8 Cell parameters: 9.058; 9.824; 14.734; 98.499; 96.322; 92.204;

COD ID: 1508337
CIF file	Formula: - C24 H34 Br Cl N4 O7 - Comments: Kopina, Brett J.; Lauhon, Charles T. Efficient preparation of 2,4-diaminopyrimidine nucleosides: total synthesis of lysidine and agmatidine. Organic letters 14(16) (2012) 4118-4121 Space group: P 1 Cell volume: 667.18 Cell parameters: 5.6722; 8.1511; 14.9077; 102.962; 94.38; 93.876;

COD ID: 1508358
CIF file	Formula: - C24 H37 N O4 - Comments: Brock, E. Anne; Davies, Stephen G.; Lee, James A.; Roberts, Paul M.; Thomson, James E. Asymmetric Synthesis of the Tropane Alkaloid (+)-Pseudococaine via Ring-Closing Iodoamination. Organic letters 14(16) (2012) 4278-4281 Space group: P 1 Cell volume: 595.75 Cell parameters: 5.6229; 8.7918; 12.5901; 81.487; 82.616; 76.535;

COD ID: 1508399

CIF file

Formula: - C56 H102.5 O50.75 -
Comments: Elasaad, Kossay; Alkhatib, Racha; Hennebelle, Thierry; Norberg, Bernadette; Wouters, Johan Determination of the Absolute Configuration of Aegelinol by Crystallization of Its Inclusion Complex with beta-Cyclodextrin Crystals 2(4) (2012) 1441-1454
Space group: P 1
Cell volume: 3618.4
Cell parameters: 15.4039; 15.2813; 17.8904; 99.662; 113.423; 102.481;

COD ID: 1508615

CIF file

Formula: - C62 H64 Ag F3 N4 O8 S -
Comments: Habata, Yoichi; Ikeda, Mari; Yamada, Sachiko; Takahashi, Hiroki; Ueno, Sumiko; Suzuki, Takatoshi; Kuwahara, Shunsuke Argentivorous molecules: structural evidence for Ag(+)-π interactions in solution. Organic letters 14(17) (2012) 4576-4579
Space group: P 1
Cell volume: 1377.5
Cell parameters: 10.1935; 10.3796; 13.4375; 79.073; 84; 81.856;

COD ID: 1508696
CIF file	Formula: - C20 H31 Br N2 O5 - Comments: Goldberg, Alexander F. G.; O'Connor, Nicholas R; Craig, 2nd, Robert A; Stoltz, Brian M. Lewis acid mediated (3 + 2) cycloadditions of donor-acceptor cyclopropanes with heterocumulenes. Organic letters 14(20) (2012) 5314-5317 Space group: P 1 Cell volume: 3388.9 Cell parameters: 8.0748; 15.1323; 29.19; 98.815; 92.189; 105.25;

COD ID: 1508808

CIF file

Formula: - C15 H29 N O3 Si -
Comments: Kashinath, K.; Vasudevan, N.; Reddy, D. Srinivasa Studies toward the synthesis of potent anti-inflammatory peptides solomonamides A and B: synthesis of a macrocyclic skeleton and key fragment 4-amino-6-(2'-amino-4'-hydroxyphenyl)-3-hydroxy-2-methyl-6-oxohexanoic acid (AHMOA) Organic Letters 14(24) (2012) 6222-6225
Space group: P 1
Cell volume: 1824.2
Cell parameters: 6.8088; 8.1381; 32.921; 90; 90; 90;

COD ID: 1508821

CIF file

Formula: - C26 H20 -
Comments: Sonoda, Yoriko; Shimoi, Yukihiro; Goto, Midori; Tohnai, Norimitsu; Kanesato, Masatoshi Fluorescence Properties of (E,E,E)-1,6-Di(n-naphthyl)-1,3,5-hexatriene (n = 1, 2): Effects of Internal Rotation. The journal of physical chemistry. A 117(3) (2013) 566-578
Space group: P 1
Cell volume: 897.4
Cell parameters: 6.95; 7.4; 17.571; 92.119; 96.424; 90.191;

COD ID: 1508882

CIF file

Formula: - C24 H19 N O5 S -
Comments: An, Jing; Lu, Liang-Qiu; Yang, Qing-Qing; Wang, Tao; Xiao, Wen-Jing Enantioselective Construction of Oxa- and Aza-Angular Triquinanes through Tandem [4 + 1]/[3 + 2] Cycloaddition of Sulfur Ylides and Nitroolefins. Organic letters 15(3) (2013) 542-545
Space group: P 1
Cell volume: 516.6
Cell parameters: 5.737; 8.686; 10.931; 83.072; 79.957; 75.074;

COD ID: 1508915
CIF file	Formula: - C38 H44 N2 O8 S - Comments: Rajapaksa, Naomi S.; McGowan, Meredeth A.; Rienzo, Matthew; Jacobsen, Eric N. Enantioselective total synthesis of (+)-reserpine. Organic letters 15(3) (2013) 706-709 Space group: P 1 Cell volume: 1707.4 Cell parameters: 10.54; 13.2962; 13.7619; 71.577; 89.697; 69.957;

COD ID: 1508932
CIF file	Formula: - C22 H14 Cl4 N2 O5 - 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: P 1 Cell volume: 1088.06 Cell parameters: 7.649; 11.8911; 12.6157; 105.779; 98.658; 92.067;

COD ID: 1510905
CIF file	Formula: - B2 Cd2 O5 - Comments: Belov, N.V.; Sokolova, E.V.; Simonov, M.A. Crystal structure of cadmium pyroborate Cd2 B2 O5 Doklady Akademii Nauk SSSR 247 (1979) 603-606 Space group: P 1 Cell volume: 210.227 Cell parameters: 6.36; 9.95; 3.45; 90.83; 91.96; 105.47;

COD ID: 1511275
CIF file	Formula: - B O3 Sm - Comments: Kuznetsova, V.G.; Dzhurinskii, B.F.; Palkina, K.K.; Butman, L.A. The crystal structure of Sm B O3 Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)) 2 (1976) 286-289 Space group: P 1 Cell volume: 236.037 Cell parameters: 6.493; 6.499; 6.242; 107.79; 107.42; 93.33;

COD ID: 1511764
CIF file	Formula: - C20 H30 Br2 N8 O13 Pd - Comments: Miguel Quirós; Juan M. Salas; M. Purificación Sánchez; André L. Beauchamp; Xavier Solans Palladium(II)-Purine Nucleoside Complexes: Synthesis, Characterization and X-ray Determination Inorganica Chimica Acta 204 (1993) 213-220 Space group: P 1 Cell volume: 717.4 Cell parameters: 6.962; 10.242; 10.547; 85.1; 73.24; 89.17;

COD ID: 1511765
CIF file	Formula: - C20 H34 Cl2 N8 O15 Pd - Comments: Miguel Quirós; Juan M. Salas; M. Purificación Sánchez; André L. Beauchamp; Xavier Solans Palladium(II)-Purine Nucleoside Complexes: Synthesis, Characterization and X-ray Determination Inorganica Chimica Acta 204 (1993) 213-220 Space group: P 1 Cell volume: 764.3 Cell parameters: 15.681; 7.406; 6.846; 92.99; 105.25; 85.48;

COD ID: 1511767
CIF file	Formula: - C23 H27 Br O4 - Comments: Alejandro F. Barrero; M. Mar Herrador; José Molina; José F. Quílez; Miguel Quirós α-Longipinene Derivatives from Santolina Viscosa. A Conformational Analysis of the Cycloheptane Ring Journal of Natural Products 57 (1994) 873-881 Space group: P 1 Cell volume: 546.6 Cell parameters: 6.669; 9.235; 10.462; 67.05; 73.43; 69.22;

COD ID: 1511789

CIF file

Formula: - C22 H42 B2 F4 Li2 O14 -
Comments: Han, Sang-Don; Allen, Joshua L.; Jónsson, Erlendur; Johansson, Patrik; McOwen, Dennis W.; Boyle, Paul D.; Henderson, Wesley A. Solvate Structures and Computational/Spectroscopic Characterization of Lithium Difluoro(oxalato)borate (LiDFOB) Electrolytes The Journal of Physical Chemistry C 117(11) (2013) 5521
Space group: P 1
Cell volume: 820.1
Cell parameters: 8.554; 8.841; 12.929; 93.573; 108.72; 114.576;

COD ID: 1511851
CIF file	Formula: - C36.25 H54 F3 N8 O6.25 - Comments: Chouhan, Gagan; James, Keith Efficient construction of proline-containing β-turn mimetic cyclic tetrapeptides via CuAAC macrocyclization. Organic letters 15(6) (2013) 1206-1209 Space group: P 1 Cell volume: 3982.82 Cell parameters: 15.0672; 15.6539; 17.4818; 97.737; 99.263; 97.544;

COD ID: 1511909

CIF file

Formula: - C20 H19 Br N4 O3 -
Comments: Chen, Xianjie; Chen, Hui; Ji, Xun; Jiang, Hualiang; Yao, Zhu-Jun; Liu, Hong Asymmetric One-Pot Sequential Mannich/Hydroamination Reaction by Organo- and Gold Catalysts: Synthesis of Spiro[pyrrolidin-3,2'-oxindole] Derivatives. Organic letters 15(8) (2013) 1846-1849
Space group: P 1
Cell volume: 1000.04
Cell parameters: 9.2928; 10.4817; 11.6022; 75.347; 66.757; 89.136;

COD ID: 1512323
CIF file	Formula: - C22 H25 N2 O10.5 - Comments: Granda, Jarosław M.; Jurczak, Janusz Sweet Anion Receptors: Recognition of Chiral Carboxylate Anions byd-Glucuronic-Acid-Decorated Diindolylmethane Organic Letters 15(18) (2013) 4730 Space group: P 1 Cell volume: 1154.59 Cell parameters: 6.3054; 9.0002; 20.798; 97.215; 92.994; 98.644;

COD ID: 1512329
CIF file	Formula: - C18 H24 Br N3 O4 - Comments: Li, Dong Bo; Rogers-Evans, Mark; Carreira, Erick M. Construction of Multifunctional Modules for Drug Discovery: Synthesis of Novel Thia/Oxa-Azaspiro[3.4]octanes. Organic letters 15(18) (2013) 4766-4769 Space group: P 1 Cell volume: 962 Cell parameters: 5.72; 11.095; 15.48; 83.6; 88.96; 80.16;

COD ID: 1512811
CIF file	Formula: - C34 H28 N4 O10 Zn - Comments: Devendra Singh; Jubaraj B. Baruah Hydroxy-carboxylates of manganese, zinc and cadmium Inorganica Chimica Acta 394 (2013) 703-709 Space group: P 1 Cell volume: 817.08 Cell parameters: 5.0612; 10.1638; 16.0051; 83.651; 88.514; 87.149;

COD ID: 1512812
CIF file	Formula: - C48 H39 Mn2 N4 O28 - Comments: Devendra Singh; Jubaraj B. Baruah Hydroxy-carboxylates of manganese, zinc and cadmium Inorganica Chimica Acta 394 (2013) 703-709 Space group: P 1 Cell volume: 1464.64 Cell parameters: 5.5897; 16.5961; 16.6125; 73.622; 85.665; 82.482;

COD ID: 1512989

CIF file

Formula: - C26 H36 N6 O15 S2 Zn2 -
Comments: Amal Cherian Kathalikkattil; P.S. Subramanian; Eringathodi Suresh Structural diversity in two dimensional chiral coordination polymers involving 4,4'bipyridine and l-cysteate as bridging ligands with Zn and Cd metal centres: Synthesis, characterization and X-ray crystallographic studies Inorganica Chimica Acta 365(1) (2011) 363-370
Space group: P 1
Cell volume: 877.8
Cell parameters: 7.5389; 10.1054; 13.185; 69.441; 81.181; 69.029;

COD ID: 1513025

CIF file

Formula: - C54 H92 Co8 N12 O45 -
Comments: Bing-Jun Zhang; Cui-Juan Wang; Guang-Mei Qiu; Shuai Huang; Xian-Li Zhou; Jie Weng; Yao-Yu Wang Polycarboxylate anions effect on the structures of a series of transition metal-based coordination polymers: Syntheses, crystal structures and bioactivities Inorganica Chimica Acta 397 (2013) 48-59
Space group: P 1
Cell volume: 2081.3
Cell parameters: 13.9081; 13.9147; 14.0033; 113.529; 111.7; 102.769;

COD ID: 1513062
CIF file	Formula: - C14 H15 Cl2 N3 O2 - Comments: Ivanova, Bojidarka; Spiteller, Michael Heptachloroepoxides - theoretical versus experimental study of the embedded samples in the matrixes of organic crystals Journal of Inclusion Phenomena and Macrocyclic Chemistry 76 (2013) 415 Space group: P 1 Cell volume: 370.4 Cell parameters: 4.8102; 5.795; 13.462; 84.048; 87.302; 83.256;

COD ID: 1513360

CIF file

Formula: - C38 H48 N4 O9 -
Comments: Low, Yun-Yee; Hong, Fong-Jiao; Lim, Kuan-Hon; Thomas, Noel F.; Kam, Toh-Seok Transformations of the 2,7-Seco Aspidosperma Alkaloid Leuconolam, Structure Revision of epi-Leuconolam, and Partial Syntheses of Leuconoxine and Leuconodines A and F. Journal of natural products 77(2) (2014) 327-338
Space group: P 1
Cell volume: 871.11
Cell parameters: 10.1848; 10.362; 10.3848; 71.742; 67.38; 60.647;

COD ID: 1513374

CIF file

Formula: - C23 H24 O8 -
Comments: Andrioli, Willian J.; Conti, Raphael; Araújo, Magali J; Zanasi, Riccardo; Cavalcanti, Bruno C.; Manfrim, Viviane; Toledo, Juliano S.; Tedesco, Daniele; de Moraes, Manoel O.; Pessoa, Cláudia; Cruz, Angela K.; Bertucci, Carlo; Sabino, José; Nanayakkara, Dhammika N. P.; Pupo, Mônica T; Bastos, Jairo K. Mycoleptones A-C and Polyketides from the Endophyte Mycoleptodiscus indicus. Journal of natural products 77(1) (2014) 70-78
Space group: P 1
Cell volume: 1055.4
Cell parameters: 10.4726; 11.2226; 11.4289; 60.65; 89.832; 67.745;

COD ID: 1513446

CIF file

Formula: - C74 H78 F8 I2 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: P 1
Cell volume: 3490.3
Cell parameters: 14.078; 15.968; 16.71; 107.796; 101.993; 90.015;

COD ID: 1513483

CIF file

Formula: - C28 H28 N2 O2 -
Comments: Weng, Jian-Quan; Deng, Qiao-Man; Wu, Liang; Xu, Kai; Wu, Hao; Liu, Ren-Rong; Gao, Jian-Rong; Jia, Yi-Xia Asymmetric Friedel-Crafts Alkylation of α-Substituted β-Nitroacrylates: Access to β(2,2)-Amino Acids Bearing Indolic All-Carbon Quaternary Stereocenters Organic Letters 16(3) (2014) 776-779
Space group: P 1
Cell volume: 1207.77
Cell parameters: 9.3592; 9.858; 13.1796; 86.612; 87.077; 84.894;

COD ID: 1513520
CIF file	Formula: - C15 H19 N3 O2 - Comments: Wu, Kui; Fan, Zhoulong; Xue, Yu; Yao, Qizheng; Zhang, Ao Rh(III)-catalyzed intermolecular C-H amination of 1-aryl-1H-pyrazol-5(4H)-ones with alkylamines. Organic letters 16(1) (2014) 42-45 Space group: P 1 Cell volume: 752.7 Cell parameters: 8.665; 8.848; 10.375; 74.678; 79.658; 83.356;

COD ID: 1513746

CIF file

Formula: - C49 H37 F6 N3 O2 S2 -
Comments: Ichikawa, Tomohiro; Morimoto, Masakazu; Irie, Masahiro Asymmetric photoreaction of a diarylethene in hydrogen-bonded cocrystals with chiral molecules. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 13(2) (2014) 199-204
Space group: P 1
Cell volume: 2228.66
Cell parameters: 11.2226; 14.6368; 14.7457; 82.159; 68.326; 88.858;

COD ID: 1513747

CIF file

Formula: - C49 H37 F6 N3 O2 S2 -
Comments: Ichikawa, Tomohiro; Morimoto, Masakazu; Irie, Masahiro Asymmetric photoreaction of a diarylethene in hydrogen-bonded cocrystals with chiral molecules. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 13(2) (2014) 199-204
Space group: P 1
Cell volume: 2228.7
Cell parameters: 11.203; 14.6411; 14.7813; 82.469; 68.116; 89.224;

COD ID: 1513752

CIF file

Formula: - C24 H27 N O6 -
Comments: Vayá, Ignacio; Andreu, Inmaculada; Jiménez, M Consuelo; Miranda, Miguel A. Photooxygenation mechanisms in naproxen-amino acid linked systems. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 13(2) (2014) 224-230
Space group: P 1
Cell volume: 534.51
Cell parameters: 4.9526; 10.2028; 10.7011; 92.352; 94.615; 96.777;

COD ID: 1513799

CIF file

Formula: - C11 H13 N5 O5 -
Comments: Zhao, Hang; Guo, Xiurong; He, Shiliang; Zeng, Xin; Zhou, Xinglong; Zhang, Chaoliang; Hu, Jing; Wu, Xiaohua; Xing, Zhihua; Chu, Liangyin; He, Yang; Chen, Qianming Complex self-assembly of pyrimido[4,5-d]pyrimidine nucleoside supramolecular structures. Nature communications 5 (2014) 3108
Space group: P 1
Cell volume: 583.54
Cell parameters: 4.9116; 8.8528; 13.96; 105.332; 93.529; 91.847;

COD ID: 1513829
CIF file	Formula: - C23 H40 I N O5 Si2 - Comments: Coste, Alexis; Bayle, Alexandre; Marrot, Jérome; Evano, Gwilherm A Convergent Synthesis of the Fully Elaborated Macrocyclic Core of TMC-95A. Organic letters 16(5) (2014) 1306-1309 Space group: P 1 Cell volume: 1355.32 Cell parameters: 9.2285; 12.5843; 12.7057; 99.428; 109.693; 94.741;

COD ID: 1514212

CIF file

Formula: - C18 H25 N O6 -
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: P 1
Cell volume: 473.4
Cell parameters: 6.5131; 7.9315; 9.954; 90.89; 94.28; 112.44;

COD ID: 1514515

CIF file

Formula: - C25 H26 Cl2 F25 N3 O8 P4 Rh2 -
Comments: Powers, David C.; Chambers, Matthew B.; Teets, Thomas S.; Elgrishi, Noémie; Anderson, Bryce L.; Nocera, Daniel G. Halogen Photoelimination from Dirhodium Phosphazane Complexes via Chloride-Bridged Intermediates. Chemical science (Royal Society of Chemistry : 2010) 4(7) (2013) 2880
Space group: P 1
Cell volume: 1104.74
Cell parameters: 10.1595; 10.386; 12.0283; 73.962; 69.049; 71.477;

COD ID: 1514536
CIF file	Formula: - C38 H62 O9 - Comments: Yu, Jun; Sun, Jiansong; Niu, Yiming; Li, Rongyao; Liao, Jinxi; Zhang, Fuyi; Yu, Biao Synthetic access toward the diverse ginsenosides Chemical Science 4(10) (2013) 3899 Space group: P 1 Cell volume: 958 Cell parameters: 8.7254; 9.5176; 12.415; 89.65; 80.46; 70.65;

COD ID: 1514550

CIF file

Formula: - C27 H32 O11 -
Comments: Gong, Wei; RajanBabu, T. V. Conformation and reactivity in dibenzocyclooctadienes (DBCOD). A general approach to the total synthesis of fully substituted DBCOD lignans via borostannylative cyclization of α,ω-diynes Chemical Science 4(10) (2013) 3979
Space group: P 1
Cell volume: 1282.95
Cell parameters: 9.4188; 9.7589; 15.1515; 96.812; 97.849; 109.187;

COD ID: 1514581

CIF file

Formula: - C28 H27 N3 O3 -
Comments: Uraguchi, Daisuke; Ueki, Yusuke; Sugiyama, Atsushi; Ooi, Takashi Highly stereoselective Michael addition of azlactones to electron-deficient triple bonds under P-spiro chiral iminophosphorane catalysis: importance of protonation pathway Chemical Science 4(3) (2013) 1308
Space group: P 1
Cell volume: 1235.4
Cell parameters: 9.552; 10.569; 13.458; 71.185; 76.497; 77.422;

COD ID: 1514677

CIF file

Formula: - C40 H54 I N3 O Pd -
Comments: Larionov, Evgeny; Nakanishi, Masafumi; Katayev, Dmitry; Besnard, Céline; Kündig, E. Peter Scope and mechanism of asymmetric C(sp3)‒H/C(Ar)‒X coupling reactions: computational and experimental study Chemical Science 4(5) (2013) 1995
Space group: P 1
Cell volume: 1926.7
Cell parameters: 11.3782; 12.8716; 13.5328; 103.493; 91.2746; 90.1766;

COD ID: 1514715
CIF file	Formula: - C16 H12 N O2 S - Comments: Liu, Bo; Huang, Yumin; Lan, Jingbo; Song, Feijie; You, Jingsong Pd-catalyzed oxidative C‒H/C‒H cross-coupling of pyridines with heteroarenes Chemical Science 4(5) (2013) 2163 Space group: P 1 Cell volume: 670.83 Cell parameters: 6.0479; 8.1021; 14.5564; 81.543; 83.748; 72.375;

COD ID: 1514777
CIF file	Formula: - C32.33 H36.66 Cl0.66 N4 O10 S Si - Comments: Coste, Alexis; Kim, Justin; Adams, Timothy C.; Movassaghi, Mohammad Concise Total Synthesis of (+)-Bionectins A and C. Chemical science (Royal Society of Chemistry : 2010) 4(8) (2013) 3191-3197 Space group: P 1 Cell volume: 3543.2 Cell parameters: 13.7346; 16.0038; 17.3585; 100.01; 92.214; 108.59;

COD ID: 1514822
CIF file	Formula: - C19 H37 Cl N8 Ni O8 Zn - Comments: Uyeda, Christopher; Peters, Jonas C. Access to formally Ni(i) states in a heterobimetallic NiZn system Chemical Science 4(1) (2013) 157 Space group: P 1 Cell volume: 1360.17 Cell parameters: 8.5274; 12.4106; 13.0776; 98.754; 96.004; 90.074;

COD ID: 1514975
CIF file	Formula: - C71 H93 Ag3 Cl4 F12 N18 O8 P2 - Comments: Wei, Siping; Li, Xiyu; Yang, Zhuang; Lan, Jingbo; Gao, Ge; Xue, Ying; You, Jingsong Ligand-switching and counteranion-induced hierarchical self-assembly of silver-NHC complexes Chemical Science 3(2) (2012) 359 Space group: P 1 Cell volume: 2128.75 Cell parameters: 12.6553; 13.0092; 15.1663; 104.239; 112.9; 99.765;

COD ID: 1515178

CIF file

Formula: - C23 H22 O5 -
Comments: Li, Jun-Long; Zhou, Si-Li; Chen, Peng-Qiao; Dong, Lin; Liu, Tian-Yu; Chen, Ying-Chun Asymmetric Diels‒Alder reaction of β,β-disubstituted enals and chromone-fused dienes: construction of collections with high molecular complexity and skeletal diversity Chemical Science 3(6) (2012) 1879
Space group: P 1
Cell volume: 476.75
Cell parameters: 7.7512; 8.1381; 8.4256; 69.558; 79.669; 74.031;

COD ID: 1515268
CIF file	Formula: - C18 H21 N O6 - Comments: Kimmel, Kyle L.; Weaver, Jimmie D.; Ellman, Jonathan A. Enantio- and diastereoselective addition of cyclohexyl Meldrum's acid to β- and α,β-disubstituted nitroalkenes via N-sulfinyl urea catalysis Chemical Science 3(1) (2012) 121 Space group: P 1 Cell volume: 1730.44 Cell parameters: 11.3125; 12.0218; 13.7304; 102.179; 107.108; 93.227;

COD ID: 1515275

CIF file

Formula: - C14 H21 N9 O6 -
Comments: Hanessian, Stephen; Maianti, Juan Pablo; Ly, Vu Linh; Deschênes-Simard, Benoît Structural and kinetic study of self-assembling macrocyclic dimer natural product aminoglycoside 66-40C and unnatural variants Chemical Science 3(1) (2012) 249
Space group: P 1
Cell volume: 3853.3
Cell parameters: 15.8942; 16.2322; 17.6688; 89.748; 72.741; 63.537;

COD ID: 1515278

CIF file

Formula: - C56 H118 N13 O47 S5 -
Comments: Hanessian, Stephen; Maianti, Juan Pablo; Ly, Vu Linh; Deschênes-Simard, Benoît Structural and kinetic study of self-assembling macrocyclic dimer natural product aminoglycoside 66-40C and unnatural variants Chemical Science 3(1) (2012) 249
Space group: P 1
Cell volume: 2534
Cell parameters: 6.6138; 16.3922; 23.9598; 101.113; 92.328; 95.176;

COD ID: 1515320

CIF file

Formula: - C35 H38 N4 Ni O5 -
Comments: Tamiaki, Hitoshi; Okamoto, Yukihiro; Mikata, Yuji; Shoji, Sunao Photooxidative cleavage of zinc 20-substituted chlorophyll derivatives: conformationally P-helix-favored formation of regioselectively 19-20 opened linear tetrapyrroles. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 11(6) (2012) 898-907
Space group: P 1
Cell volume: 1506.4
Cell parameters: 10.232; 12.112; 12.792; 76.697; 79.053; 81.737;

COD ID: 1515345
CIF file	Formula: - C142 H226 N10 O16 - Comments: Svobodová, Hana; Nonappa,; Lahtinen, Manu; Wimmer, Zdeněk; Kolehmainen, Erkki A steroid-based gelator of A(LS)2 type: tuning gel properties by metal coordination Soft Matter 8(30) (2012) 7840 Space group: P 1 Cell volume: 3336.63 Cell parameters: 6.1385; 14.6387; 37.9634; 83.436; 86; 80.353;

COD ID: 1515556
CIF file	Formula: - C96 H102 Cl N5 O20 - Comments: Leontiev, Alexandre V.; Serpell, Christopher J.; White, Nicholas G.; Beer, Paul D. Cation-induced molecular motion of spring-like [2]catenanes Chemical Science 2(5) (2011) 922 Space group: P 1 Cell volume: 4461 Cell parameters: 11.009; 17.213; 25.06; 73.3; 82.6; 79.77;

COD ID: 1515785
CIF file	Formula: - C104 H151 N11 O10 - Comments: Gale, Philip A.; Hiscock, Jennifer R.; Jie, Chen Zhu; Hursthouse, Michael B.; Light, Mark E. Acyclic indole and carbazole-based sulfate receptors Chemical Science 1(2) (2010) 215 Space group: P 1 Cell volume: 2429.96 Cell parameters: 8.932; 12.45; 22.583; 93.679; 100.549; 98.64;

COD ID: 1515870

CIF file

Formula: - C77 H56 B F24 Ir N O 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: P 1
Cell volume: 3487.6
Cell parameters: 12.8218; 14.836; 18.8757; 96.898; 99.557; 95.874;

COD ID: 1515871

CIF file

Formula: - C23 H19 N O -
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: P 1
Cell volume: 1704.86
Cell parameters: 7.6503; 12.8616; 18.8654; 106.228; 98.815; 101.265;

COD ID: 1515999
CIF file	Formula: - C61 H48 Cl Fe O3 P2 Rh - Comments: Tanaka, Kenichi; Kinbara, Kazushi Toward autonomously operating molecular machines driven by transition-metal catalyst. Molecular bioSystems 4(6) (2008) 512-514 Space group: P 1 Cell volume: 1221.5 Cell parameters: 9.356; 10.965; 12.863; 75.982; 74.937; 78.025;

COD ID: 1516022
CIF file	Formula: - C36.5 H68 O15.5 - Comments: Huang, Yu-Jie; Lu, Hui; Yu, Xue-Li; Zhang, Shu-Wei; Wang, Wen-Qiong; Fen, Lin-Yin; Xuan, Li-Jiang Dammarane-Type Triterpenoids from Gentianella azurea. Journal of natural products 77(5) (2014) 1201 Space group: P 1 Cell volume: 1880.95 Cell parameters: 7.1558; 12.8203; 21.033; 85.657; 88.636; 77.863;

COD ID: 1516269
CIF file	Formula: - C73 H48 B F15 O7 U - Comments: Pedrick, E. A.; Wu, G.; Kaltsoyannis, N.; Hayton, T. W. Reductive silylation of a uranyl dibenzoylmethanate complex: an example of controlled uranyl oxo ligand cleavage Chemical Science 5(8) (2014) 3204 Space group: P 1 Cell volume: 3157 Cell parameters: 15.1204; 16.1764; 16.4479; 112.966; 96.391; 115.286;

COD ID: 1516334

CIF file

Formula: - C24 H21 Br2 N -
Comments: Thyrhaug, Erling; Hammershøj, Peter; Kjær, Kasper S; Sørensen, Thomas Just; Harrit, Niels H.; Nielsen, Martin M.; Bechgaard, Klaus Excited state kinetics of anthracene-bridge-aniline intramolecular exciplexes Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 13(7) (2014) 1093-1105
Space group: P 1
Cell volume: 1971.1
Cell parameters: 8.187; 9.207; 27.256; 90.044; 89.948; 106.384;

COD ID: 1516351

CIF file

Formula: - C28 H60 O2 P2 Pd S2 -
Comments: Vitaliano, Rosa; Fratoddi, Ilaria; Venditti, Iole; Roviello, Giuseppina; Battocchio, Chiara; Polzonetti, Giovanni; Russo, Maria Vittoria Self-assembled monolayers based on Pd-containing organometallic thiols: preparation and structural characterization. The journal of physical chemistry. A 113(52) (2009) 14730-14740
Space group: P 1
Cell volume: 917.8
Cell parameters: 8.538; 10.605; 11.064; 67.828; 81.864; 85.056;

COD ID: 1516526
CIF file	Formula: - C28 H30 N2 O3 - Comments: Kise, Naoki; Hamada, Yusuke; Sakurai, Toshihiko Electroreductive Coupling of Optically Active α,β-Unsaturated Carbonyl Compounds with Diaryl Ketones: Asymmetric Synthesis of 4,5,5-Trisubstituted γ-Butyrolactones. Organic letters 16(12) (2014) 3348-3351 Space group: P 1 Cell volume: 1191 Cell parameters: 6.63; 8.27; 22.07; 89.6; 87.7; 80;

COD ID: 1516734

CIF file

Formula: - C108 H170 N2 O100 -
Comments: Clark, Joanna L.; Peinado, Jessica; Stezowski, John J.; Vold, Robert L.; Huang, Yuanyuan; Hoatson, Gina L. Molecular recognition in cyclodextrin complexes of amino acid derivatives: the effects of kinetic energy on the molecular recognition of a pseudopeptide in a nonconstraining host environment as revealed by a temperature-dependent crystallographic study. The journal of physical chemistry. B 110(51) (2006) 26375-26387
Space group: P 1
Cell volume: 3711.9
Cell parameters: 18.071; 15.375; 15.554; 104.07; 113.02; 98.53;

COD ID: 1516735

CIF file

Formula: - C108 H170 N2 O97 -
Comments: Clark, Joanna L.; Peinado, Jessica; Stezowski, John J.; Vold, Robert L.; Huang, Yuanyuan; Hoatson, Gina L. Molecular recognition in cyclodextrin complexes of amino acid derivatives: the effects of kinetic energy on the molecular recognition of a pseudopeptide in a nonconstraining host environment as revealed by a temperature-dependent crystallographic study. The journal of physical chemistry. B 110(51) (2006) 26375-26387
Space group: P 1
Cell volume: 3699.8
Cell parameters: 18.025; 15.364; 15.541; 103.83; 113.06; 98.61;

COD ID: 1516736

CIF file

Formula: - C108 H170 N2 O99 -
Comments: Clark, Joanna L.; Peinado, Jessica; Stezowski, John J.; Vold, Robert L.; Huang, Yuanyuan; Hoatson, Gina L. Molecular recognition in cyclodextrin complexes of amino acid derivatives: the effects of kinetic energy on the molecular recognition of a pseudopeptide in a nonconstraining host environment as revealed by a temperature-dependent crystallographic study. The journal of physical chemistry. B 110(51) (2006) 26375-26387
Space group: P 1
Cell volume: 3693.4
Cell parameters: 17.97; 15.393; 15.514; 103.18; 113.22; 98.91;

COD ID: 1516737

CIF file

Formula: - C108 H170 N2 O102 -
Comments: Clark, Joanna L.; Peinado, Jessica; Stezowski, John J.; Vold, Robert L.; Huang, Yuanyuan; Hoatson, Gina L. Molecular recognition in cyclodextrin complexes of amino acid derivatives: the effects of kinetic energy on the molecular recognition of a pseudopeptide in a nonconstraining host environment as revealed by a temperature-dependent crystallographic study. The journal of physical chemistry. B 110(51) (2006) 26375-26387
Space group: P 1
Cell volume: 3685.5
Cell parameters: 17.915; 15.405; 15.542; 103.04; 113.35; 99.15;

COD ID: 1516738

CIF file

Formula: - C108 H170 N2 O100 -
Comments: Clark, Joanna L.; Peinado, Jessica; Stezowski, John J.; Vold, Robert L.; Huang, Yuanyuan; Hoatson, Gina L. Molecular recognition in cyclodextrin complexes of amino acid derivatives: the effects of kinetic energy on the molecular recognition of a pseudopeptide in a nonconstraining host environment as revealed by a temperature-dependent crystallographic study. The journal of physical chemistry. B 110(51) (2006) 26375-26387
Space group: P 1
Cell volume: 3672
Cell parameters: 17.896; 15.389; 15.519; 103.01; 113.43; 99.07;

COD ID: 1516739

CIF file

Formula: - C108 H154 N2 O101 -
Comments: Clark, Joanna L.; Peinado, Jessica; Stezowski, John J.; Vold, Robert L.; Huang, Yuanyuan; Hoatson, Gina L. Molecular recognition in cyclodextrin complexes of amino acid derivatives: the effects of kinetic energy on the molecular recognition of a pseudopeptide in a nonconstraining host environment as revealed by a temperature-dependent crystallographic study. The journal of physical chemistry. B 110(51) (2006) 26375-26387
Space group: P 1
Cell volume: 3596
Cell parameters: 17.78; 15.31; 15.35; 102.76; 113.31; 99.24;

COD ID: 1516764
CIF file	Formula: - C13 H17 N O S - Comments: Guntreddi, Tirumaleswararao; Vanjari, Rajeshwer; Singh, Krishna Nand Decarboxylative Thioamidation of Arylacetic and Cinnamic Acids: A New Approach to Thioamides. Organic letters 16(14) (2014) 3624 Space group: P 1 Cell volume: 638.8 Cell parameters: 6.208; 7.7318; 14; 100.602; 91.28; 104.16;

COD ID: 1516961
CIF file	Formula: - C38 H32 N2 O2 Pd - Comments: Takashi Tsuno; Haruka Iwabe; Henri Brunner Synthesis and structural characterization of isomeric palladium(II) complexes with chiral N,O-bidentate ligands Inorganica Chimica Acta 400 (2013) 262-266 Space group: P 1 Cell volume: 1600.9 Cell parameters: 6.683; 15.639; 15.685; 88.127; 84.123; 79.058;

COD ID: 1516968
CIF file	Formula: - C23 H19 Br O4 - 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: P 1 Cell volume: 943.3 Cell parameters: 8.0129; 8.8764; 14.284; 75.661; 88.56; 73.636;

COD ID: 1517178
CIF file	Formula: - C22 H19 Cl N2 O2 S - Comments: Wang, Hui; Li, Yi; Xu, Ming-Hua Rhodium-catalyzed highly enantioselective arylation of cyclic diketimines: efficient synthesis of chiral tetrasubstituted 1,2,5-thiadiazoline 1,1-dioxides. Organic letters 16(15) (2014) 3962-3965 Space group: P 1 Cell volume: 981.34 Cell parameters: 10.0479; 10.4624; 10.6624; 93.078; 90.52; 118.662;

COD ID: 1517195
CIF file	Formula: - C16 H12 Br N O - Comments: Zhao, Depeng; Fañanás-Mastral, Martín; Chang, Mu-Chieh; Otten, Edwin; Feringa, Ben L. Asymmetric synthesis of N,O-heterocycles via enantioselective iridium-catalysed intramolecular allylic amidation Chem. Sci. 5(11) (2014) 4216 Space group: P 1 Cell volume: 678.53 Cell parameters: 6.3154; 8.1371; 14.3362; 85.222; 78.52; 70.043;

COD ID: 1517210

CIF file

Formula: - C56 H66 F6 N4 O6 Zn2 -
Comments: Ellis, W. Chadwick; Jung, Yukyung; Mulzer, Michael; Di Girolamo, Rocco; Lobkovsky, Emil B.; Coates, Geoffrey W. Copolymerization of CO2and meso epoxides using enantioselective β-diiminate catalysts: a route to highly isotactic polycarbonates Chemical Science 5(10) (2014) 4004
Space group: P 1
Cell volume: 1356.84
Cell parameters: 10.3348; 10.8803; 13.2532; 113.176; 96.805; 91.083;

COD ID: 1517233
CIF file	Formula: - C19 H21 N O3 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: P 1 Cell volume: 876.2 Cell parameters: 7.176; 10.859; 12.059; 100.648; 106.125; 95.565;

COD ID: 1517266

CIF file

Formula: - C65 H87 N O14 -
Comments: Yang, Yong-Xun; Shan, Lei; Liu, Qing-Xin; Shen, Yun-Heng; Zhang, Jian-Ping; Ye, Ji; Xu, Xi-Ke; Li, Hui-Liang; Zhang, Wei-Dong Carpedilactones A-D, Four New Isomeric Sesquiterpene Lactone Dimers with Potent Cytotoxicity from Carpesium faberi. Organic letters 16(16) (2014) 4216-4219
Space group: P 1
Cell volume: 1426.49
Cell parameters: 11.0003; 11.3149; 11.9224; 88.459; 75.604; 82.956;

COD ID: 1517364
CIF file	Formula: - C103 H57 B F46 Mn N O P4 - Comments: Hulley, Elliott B.; Helm, Monte L.; Bullock, R. Morris Heterolytic cleavage of H2by bifunctional manganese(i) complexes: impact of ligand dynamics, electrophilicity, and base positioning Chem. Sci. 5(12) (2014) 4729 Space group: P 1 Cell volume: 2474.82 Cell parameters: 13.826; 14.0301; 14.8023; 108.714; 109.969; 96.491;

COD ID: 1517403

CIF file

Formula: - C35 H35 O17.5 S1.5 -
Comments: Zhou, Xue-Ming; Zheng, Cai-Juan; Chen, Guang-Ying; Song, Xiao-Ping; Han, Chang-Ri; Li, Gao-Nan; Fu, Yan-Hui; Chen, Wen-Hao; Niu, Zhi-Gang Bioactive Anthraquinone Derivatives from the Mangrove-Derived Fungus Stemphylium sp. 33231. Journal of natural products 77(9) (2014) 2021-2028
Space group: P 1
Cell volume: 1791.47
Cell parameters: 9.18695; 9.48126; 21.1713; 82.38; 83.5029; 79.8305;

COD ID: 1517804

CIF file

Formula: - C30 H48 O7 -
Comments: Li, Man-Man; Su, Xiao-Qin; Sun, Jing; Gu, Yu-Fan; Huang, Zheng; Zeng, Ke-Wu; Zhang, Qian; Zhao, Yun-Fang; Ferreira, Daneel; Zjawiony, Jordan K.; Li, Jun; Tu, Peng-Fei Anti-inflammatory Ursane- and Oleanane-Type Triterpenoids from Vitex negundo var. cannabifolia. Journal of natural products 77(10) (2014) 2248-2254
Space group: P 1
Cell volume: 2679.35
Cell parameters: 12.9465; 14.7156; 15.0171; 89.616; 73.336; 78.252;

COD ID: 1517814

CIF file

Formula: - C36 H40 Br2 O6 -
Comments: Kanoh, Naoki; Kawamata, Ayano; Itagaki, Tomohiro; Miyazaki, Yuta; Yahata, Kenzo; Kwon, Eunsang; Iwabuchi, Yoshiharu A Concise and Unified Strategy for Synthesis of the C1-C18 Macrolactone Fragments of FD-891, FD-892 and Their Analogues: Formal Total Synthesis of FD-891. Organic letters 16(19) (2014) 5216-5219
Space group: P 1
Cell volume: 1728.1
Cell parameters: 7.58; 12.228; 20.041; 97.8; 97; 107.58;

COD ID: 1517959
CIF file	Formula: - C11 H9 Cl N4 O2 - Comments: Wu, Xiu-Ping; Su, Yan; Gu, Peiming Catalytic Enantioselective Desymmetrization of 1,3-Diazido-2-propanol via Intramolecular Interception of Alkyl Azides with Diazo(aryl)acetates. Organic letters 16(20) (2014) 5339-5341 Space group: P 1 Cell volume: 588.55 Cell parameters: 7.0512; 8.2526; 10.6656; 73.101; 82.494; 86.39;

COD ID: 1518071

CIF file

Formula: - C17 H26 N2 O9 -
Comments: Blériot, Yves; Auberger, Nicolas; Jagadeesh, Yerri; Gauthier, Charles; Prencipe, Giuseppe; Tran, Anh Tuan; Marrot, Jérôme; Désiré, Jérôme; Yamamoto, Arisa; Kato, Atsushi; Sollogoub, Matthieu Synthesis of 1,2-cis-Homoiminosugars Derived from GlcNAc and GalNAc Exploiting a β-Amino Alcohol Skeletal Rearrangement. Organic letters 16(21) (2014) 5512-5515
Space group: P 1
Cell volume: 516.78
Cell parameters: 5.0198; 9.5967; 10.9206; 84.776; 82.397; 83.744;

COD ID: 1518131

CIF file

Formula: - C18 H29 N O3 -
Comments: Arai, Kenzo; Buonamici, Silvia; Chan, Betty; Corson, Laura; Endo, Atsushi; Gerard, Baudouin; Hao, Ming-Hong; Karr, Craig; Kira, Kazunobu; Lee, Linda; Liu, Xiang; Lowe, Jason T.; Luo, Tuoping; Marcaurelle, Lisa A.; Mizui, Yoshiharu; Nevalainen, Marta; O'Shea, Morgan Welzel; Park, Eun Sun; Perino, Samantha A.; Prajapati, Sudeep; Shan, Mingde; Smith, Peter G.; Tivitmahaisoon, Parcharee; Wang, John Yuan; Warmuth, Markus; Wu, Kuo-Ming; Yu, Lihua; Zhang, Huiming; Zheng, Guo-Zhu; Keaney, Gregg F. Total Synthesis of 6-Deoxypladienolide D and Assessment of Splicing Inhibitory Activity in a Mutant SF3B1 Cancer Cell Line. Organic letters 16(21) (2014) 5560-5563
Space group: P 1
Cell volume: 932.3
Cell parameters: 5.8126; 12.6069; 13.068; 102.911; 92.604; 90.251;

COD ID: 1518344
CIF file	Formula: - C24 H26 N2 O5 - Comments: Cabanillas, Alejandro; Davies, Christopher D.; Male, Louise; Simpkins, Nigel S. Highly enantioselective access to diketopiperazines via cinchona alkaloid catalyzed Michael additions Chem. Sci. 6(2) (2015) 1350 Space group: P 1 Cell volume: 1047.35 Cell parameters: 6.25441; 12.592; 13.61853; 100.755; 92.7028; 95.0674;

COD ID: 1518416

CIF file

Formula: - C34 H35 N O14 -
Comments: Moon, Kyuho; Chung, Beomkoo; Shin, Yoonho; Rheingold, Arnold L.; Moore, Curtis E.; Park, Sung Jean; Park, Sunghyouk; Lee, Sang Kook; Oh, Ki-Bong; Shin, Jongheon; Oh, Dong-Chan Pentacyclic antibiotics from a tidal mud flat-derived actinomycete. Journal of natural products 78(3) (2015) 524-529
Space group: P 1
Cell volume: 1548.85
Cell parameters: 7.4957; 12.0298; 17.8347; 87.387; 87.555; 74.708;

COD ID: 1518484
CIF file	Formula: - C54 H75 N8 O16 S - Comments: Ganesh Kumar, Mothukuri; Mali, Sachitanand M.; Raja, K. Muruga Poopathi; Gopi, Hosahudya N. Design of Stable β-Hairpin Mimetics through Backbone Disulfide Bonds. Organic letters 17(2) (2015) 230-233 Space group: P 1 Cell volume: 1499.6 Cell parameters: 9.1948; 12.5947; 13.668; 79.379; 77.83; 78.547;

COD ID: 1518546

CIF file

Formula: - C9 H5 F3 Mo O3 -
Comments: Hauser, Simone A.; Reich, Robert M.; Mink, János; Pöthig, Alexander; Cokoja, Mirza; Kühn, Fritz E. Influence of structural and electronic properties of organomolybdenum(ii) complexes of the type [CpMo(CO)3R] and [CpMo(O2)(O)R] (R = Cl, CH3, CF3) on the catalytic olefin epoxidation Catal. Sci. Technol. 5(4) (2015) 2282
Space group: P 1
Cell volume: 253.356
Cell parameters: 6.453; 6.544; 6.7851; 107.752; 97.132; 107.192;

COD ID: 1518618
CIF file	Formula: - C20 H17 Br N2 O - Comments: Fu, Niankai; Zhang, Long; Luo, Sanzhong Chiral Primary Amine Catalyzed Asymmetric Michael Addition of Malononitrile to α-Substituted Vinyl Ketone. Organic letters 17(2) (2015) 382-385 Space group: P 1 Cell volume: 884.6 Cell parameters: 9.8359; 10.161; 10.307; 76.557; 73.136; 64.754;

COD ID: 1518777
CIF file	Formula: - C28 H36 F36 Mg2 N8 O26 S12 - Comments: Giffin, Guinevere A.; Tannert, Jens; Jeong, Sangsik; Uhl, Werner; Passerini, Stefano Crystalline Complexes of Pyr12O1TFSI-Based Ionic Liquid Electrolytes The Journal of Physical Chemistry C 119(11) (2015) 5878 Space group: P 1 Cell volume: 1765.86 Cell parameters: 11.4359; 12.0538; 13.8956; 69.152; 82.96; 81.651;

COD ID: 1518820

CIF file

Formula: - C23 H17 N O -
Comments: Yang, Xiao-Fei; Hu, Xu-Hong; Loh, Teck-Peng Expedient Synthesis of Pyrroloquinolinones by Rh-Catalyzed Annulation of N-Carbamoyl Indolines with Alkynes through a Directed C-H Functionalization/C-N Cleavage Sequence. Organic letters 17(6) (2015) 1481-1484
Space group: P 1
Cell volume: 1633.82
Cell parameters: 9.9575; 10.7208; 16.4862; 91.531; 105.749; 104.208;

COD ID: 1519161
CIF file	Formula: - C24 H12 N6 - Comments: Janczak, Jan; Kubiak, Ryszard Tris(2-cyanophenyl)-1,3,5-triazine: a By-product of Metallophthalocyanine Synthesis Acta Chemica Scandinavica 53 (1999) 602-610 Space group: P 1 Cell volume: 1431.4 Cell parameters: 11.276; 12.833; 12.915; 99.7; 112.31; 115.53;

COD ID: 1519350
CIF file	Formula: - C18 H51 Na3 O15 Si3 - Comments: Taylor, Peter. G.; Gelbrich, Thomas; Hursthouse, Michael B. C36H102Na6O30Si6 Crystal Structure Report Archive (2001) 826 Space group: P 1 Cell volume: 1565.16 Cell parameters: 9.1615; 10.1143; 18.1371; 88.586; 80.238; 70.995;

COD ID: 1519496
CIF file	Formula: - C22 H20 Br N - Comments: Zhang, Zhenhua; Du, Haifeng Cis-selective and highly enantioselective hydrogenation of 2,3,4-trisubstituted quinolines. Organic letters 17(11) (2015) 2816-2819 Space group: P 1 Cell volume: 440.2 Cell parameters: 6.134; 7.123; 10.777; 102.328; 106.299; 90.659;

COD ID: 1519904
CIF file	Formula: - C12 H25 N O5 - Comments: Callear, Samantha K.; Hursthouse, Michael B. 1,1,3,3-Tetramethylbutylammonium malate Crystal Structure Report Archive (2008) 560 Space group: P 1 Cell volume: 355 Cell parameters: 6.1782; 7.5786; 8.0969; 100.526; 91.585; 107.06;

COD ID: 1519956
CIF file	Formula: - C13 H28 N2 O14 - Comments: Callear, Samantha K.; Hursthouse, Michael B.; Threlfall, Terence L. 1-Methylpiperazinium di(L-tartrate) dihydrate Crystal Structure Report Archive (2008) 583 Space group: P 1 Cell volume: 936.72 Cell parameters: 7.4774; 7.7071; 16.2943; 88.321; 86.355; 89.778;

COD ID: 1519975
CIF file	Formula: - C5 H11 N O6 - Comments: Callear, Samantha K.; Hursthouse, Michael B.; Threlfall, Terence L. Methylammonium L-tartrate Crystal Structure Report Archive (2008) 579 Space group: P 1 Cell volume: 198.31 Cell parameters: 5.158; 5.3261; 7.5218; 78.735; 83.33; 79.077;

COD ID: 1520139

CIF file

Formula: - C34 H38 N4 O2 -
Comments: Faggi, Enrico; Gavara, Raquel; Bolte, Michael; Fajarí, Lluís; Juliá, Luís; Rodríguez, Laura; Alfonso, Ignacio Copper(ii) complexes of macrocyclic and open-chain pseudopeptidic ligands: synthesis, characterization and interaction with dicarboxylates. Dalton transactions (Cambridge, England : 2003) 44(28) (2015) 12700-12710
Space group: P 1
Cell volume: 1467.5
Cell parameters: 9.631; 10.027; 15.551; 86.83; 87.67; 78.27;

COD ID: 1520481
CIF file	Formula: - C13 H0 F3 N - Comments: Tizzard, G.; Threlfall, T.; Ling, S.; Coles, S. (E)-2,4-difluoro-N-(4-fluorobenzylidene)aniline Crystal Structure Report Archive (2010) 1426 Space group: P 1 Cell volume: 1034 Cell parameters: 6.3923; 7.4769; 21.635; 90; 90.03; 90;

COD ID: 1520534
CIF file	Formula: - C20 H20 N4 O4 - Comments: Park, Jung-Woo; Kou, Kevin G. M.; Kim, Daniel K.; Dong, Vy M. Rh-Catalyzed Desymmetrization of α-Quaternary Centers by Isomerization-Hydroacylation. Chemical science (Royal Society of Chemistry : 2010) 6(8) (2015) 4479-4483 Space group: P 1 Cell volume: 1856 Cell parameters: 7.9466; 14.9541; 16.2556; 78.9198; 79.5663; 82.7612;

COD ID: 1521026
CIF file	Formula: - O11 Sr3 Te4 - Comments: Dytyatev, O.A.; Dolgikh, V.A. On the crystal structure of a new binary oxide Sr3 Te4 O11 Materials Research Bulletin 34 (1999) 733-740 Space group: P 1 Cell volume: 595.586 Cell parameters: 7.531; 9.24; 9.546; 98.07; 109.55; 102.19;

COD ID: 1521822
CIF file	Formula: - H4.9 Mo O8.45 U - Comments: Rastsvetaeva, R.K.; Barinova, A.V.; Sidorenko, G.A.; Pushcharovskii, D.Yu. Crystal structure of triclinic umohoite (U Mo O6 (H2 O)) . (H2 O) Doklady Akad. Nauk 373 (2000) 202-205 Space group: P 1 Cell volume: 698.091 Cell parameters: 14.69; 7.535; 6.372; 90.07; 85.9; 97.1;

COD ID: 1522058
CIF file	Formula: - Al H4 O6 P - Comments: Tuel, A.; Baerlocher, C.; Meden, A.; Caldarelli, S.; McCusker, L.B.; Kaucic, V.; Ristic, A.; Rajic, N.; Mali, G. NMR characterization and Rietveld refinement of the structure of rehydrated (Al P O4)-34 J. Phys. Chem. B 104 (2000) 5697-5705 Space group: P 1 Cell volume: 766.381 Cell parameters: 9.026; 9.338; 9.508; 95.1; 104.1; 96.6;

COD ID: 1523329
CIF file	Formula: - Co Na4 O3 - Comments: Burow, W.; Hoppe, R. Zur Kenntnis der Oxocobaltate(II) Na4 (Co O3), ein Nesocobaltat(II) Zeitschrift fuer Anorganische und Allgemeine Chemie 459 (1979) 59-71 Space group: P 1 Cell volume: 236.065 Cell parameters: 8.144; 6.22; 5.758; 117.54; 89.99; 111.24;

COD ID: 1524300
CIF file	Formula: - Fe O6 Si4 - Comments: Eggleton, R.A.; Bailey, S.W. The crystal structure of stilpnomelane. Part I. The subcell Clays and Clay Minerals (-28,1980) 13 (1966) 49-63 Space group: P 1 Cell volume: 317.125 Cell parameters: 5.431; 5.431; 17.73999; 124.14; 95.86; 120;

COD ID: 1525883
CIF file	Formula: - Fe6.314 H4 K1.875 Na O31 Si8 Ti2 - Comments: Ma, Z.-S.; Li, G.-W.; Zhou, H.-Y.; Shi, N.-C.; Pushcharovskii, D.Yu.; Ye, D.-I. Structure refinement of astrophyllite Science in China Series D 44 (2001) 508-516 Space group: P 1 Cell volume: 649.457 Cell parameters: 5.359; 11.614; 11.861; 113.16; 103.04; 94.56;

COD ID: 1525950
CIF file	Formula: - Ga2 O11 Te4 - Comments: Dutreilh, M.; Thomas, P.; Frit, B.; Champarnaud-Mesjard, J.C. Crystal structure of a new gallium tellurite: Ga2 Te4 O11 Solid State Sciences 3 (2001) 423-431 Space group: P 1 Cell volume: 247.938 Cell parameters: 5.125; 6.559; 8.173; 75.06; 89.25; 69.62;

COD ID: 1526013
CIF file	Formula: - B5 Ca Cl H2 O10 Sr - Comments: Ferro, O.; Pekov, I.V.; Pushcharovskii, D.Yu.; Lovskaya, E.V.; Teat, S.; Vinogradova, S.A. Crystal structure of strontian hilgardite Kristallografiya 45 (2000) 452-457 Space group: P 1 Cell volume: 206.872 Cell parameters: 6.5732; 6.4445; 6.3693; 60.995; 61.257; 77.191;

COD ID: 1526063
CIF file	Formula: - D18 N4 O12 Se3 - Comments: Fukami, T.; Chen, R.H. Structural phase transition and crystal structure for (N D4)4 D2 (Se O4)3 at low temperature Acta Physica Polonica, A 100 (2001) 53-65 Space group: P 1 Cell volume: 705.998 Cell parameters: 7.65; 10.336; 10.509; 114.34; 93.29; 107.53;

COD ID: 1526340
CIF file	Formula: - Cu O3 V - Comments: Rea, J.R.; Bless, P.W.; Kostiner, E. The Crystal Structure of Cu V O3, a Distorted Ilmenite-Type Derivative Journal of Solid State Chemistry 5 (1972) 446-451 Space group: P 1 Cell volume: 99.496 Cell parameters: 4.9646; 5.4023; 4.9154; 90.32; 119.31; 63.93;

COD ID: 1526580
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: P 1 Cell volume: 99.336 Cell parameters: 6.57; 4.056; 3.7288; 89.48; 90.53; 88.84;

COD ID: 1527052
CIF file	Formula: - O5.96 Pb2.667 V1.333 - Comments: Zyryanov, V.V.; Lapina, O.B. Mechanochemical synthesis and structure of new phases in the Pb - V - O system Neorganicheskie Materialy 37 (2001) 331-337 Space group: P 1 Cell volume: 161.612 Cell parameters: 6.075; 4.384; 6.124; 84.4; 93.25; 94.55;

COD ID: 1528084
CIF file	Formula: - Gd2 Ge2 O7 - Comments: Smolin, Yu.I.; Butikova, I.K.; Shepelev, Yu.F. Determination of the crystal structure of Gd2 Ge2 O7 Kristallografiya 16 (1971) 911-917 Space group: P 1 Cell volume: 859.188 Cell parameters: 18.5; 6.8; 6.858; 87.88; 91.52; 94.55;

COD ID: 1528470
CIF file	Formula: - C13 H52 N6.5 O129.125 P4 W30 Zr - Comments: Fang Xikui; Hill, C.L. Multiple reversible protonation of polyoxoaniom surfaces: direct observation of dynamic structural effects from proton transfer Angewandte Chemie (Edition international) 46 (2007) 3877-3880 Space group: P 1 Cell volume: 7059.89 Cell parameters: 15.325; 21.014; 22.173; 83.639; 89.636; 84.175;

COD ID: 1528767
CIF file	Formula: - N2 O2 Si2 Sr1.02 - Comments: Oeckler, O.; Stadler, F.; Schnick, W.; Rosenthal, T. Real structure of Sr Si2 O2 N2 Solid State Sciences 9 (2007) 205-212 Space group: P 1 Cell volume: 358.727 Cell parameters: 7.08021; 7.23058; 7.25535; 88.7669; 84.7333; 75.9047;

COD ID: 1528811
CIF file	Formula: - Al Ca16 Cl4 H Mg2 O32 Si7 - Comments: Rastsvetaeva, R.K.; Zadov, A.E.; Chukanov, N.V. Crystal structure of low-symmetry rondorfite Kristallografiya 53 (2008) 226-232 Space group: P 1 Cell volume: 3443.4 Cell parameters: 15.1; 15.11; 15.092; 90.06; 90.01; 89.93;

COD ID: 1529313

CIF file

Formula: - C27 H29 Br N O6 P -
Comments: Horwitz, Matthew A.; Tanaka, Naoya; Yokosaka, Takuya; Uraguchi, Daisuke; Johnson, Jeffrey S.; Ooi, Takashi Enantioselective reductive multicomponent coupling reactions between isatins and aldehydes. Chemical science (Royal Society of Chemistry : 2010) 6(11) (2015) 6086-6090
Space group: P 1
Cell volume: 2624.1
Cell parameters: 10.2391; 11.4922; 24.9637; 91.304; 98.318; 114.935;

COD ID: 1529799
CIF file	Formula: - O8 Se2 Te2 - Comments: Delage, C.; Goursolle, M.; Carpy, A. The Te O2 - Se O2 system. Crystal structure of Te2 Se2 O8. Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie C, Sciences Chimiques (1966-) 295 (1982) 981-983 Space group: P 1 Cell volume: 181.654 Cell parameters: 4.356; 6.701; 7.385; 116.79; 106.78; 90.71;

COD ID: 1530014

CIF file

Formula: - F4 N O3 Rb Te -
Comments: Gorbunova, Yu.E.; Linde, S.A.; Kokunov, Yu.V.; Pakhomov, V.I.; Buslaev, Yu.A.; Gustyakova, M.P. Synthesis and structure of Te(IV) fluoride nitrates and chloride fluorides Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)) 10 (1984) 340-349
Space group: P 1
Cell volume: 654.867
Cell parameters: 8.216; 8.454; 10.794; 109.09; 89.89; 111.18;

COD ID: 1530118
CIF file	Formula: - I K O3 - Comments: Kalinin, V.P.; Ilyukhin, V.V.; Belov, N.V. About the crystal structure of the triclinic modification of potassium iodate Doklady Akademii Nauk SSSR 239 (1978) 590-593 Space group: P 1 Cell volume: 355.253 Cell parameters: 7.71; 7.701; 7.698; 109.06; 109.27; 109.29;

COD ID: 1530127
CIF file	Formula: - Rb S2 Sb - Comments: Kanishcheva, A.S.; Kuznetsov, V.G.; Lazarev, V.B.; Tarasova, T.G. Crystal structure of Rb Sb S2 Zhurnal Strukturnoi Khimii (Issue-No. from 1981) 18 (1977) 1069-1072 Space group: P 1 Cell volume: 472.293 Cell parameters: 6.473; 6.473; 12.439; 103.58; 101.77; 104.04;

COD ID: 1530347

CIF file

Formula: - B F4 H2 N3 S3 -
Comments: Marcellus, C.G.; Oakley, R.T.; Cordes, A.W.; Pennington, W.T. The preparation and the crystal and molecular structure of (S3 N2 N H2)(+) (B F4)(-); a molecular orbital study of the protonation of the trisulphur trinitride anion Canadian Journal of Chemistry 62 (1984) 1822-1827
Space group: P 1
Cell volume: 372.601
Cell parameters: 5.445; 7.346; 9.473; 85.89; 83.92; 82.13;

COD ID: 1530392

CIF file

Formula: - C29 H44 O4 -
Comments: Hu, Zheng-Xi; Shi, Yi-Ming; Wang, Wei-Guang; Li, Xiao-Nian; Du, Xue; Liu, Miao; Li, Yan; Xue, Yong-Bo; Zhang, Yong-Hui; Pu, Jian-Xin; Sun, Han-Dong Kadcoccinones A-F, New Biogenetically Related Lanostane-Type Triterpenoids with Diverse Skeletons from Kadsura coccinea. Organic letters 17(18) (2015) 4616-4619
Space group: P 1
Cell volume: 1277.24
Cell parameters: 7.357; 11.5004; 15.8083; 101.789; 102.383; 90.228;

COD ID: 1530486
CIF file	Formula: - Ca Ge2 O5 - Comments: Nevskii, N.N.; Ilyukhin, V.V.; Belov, N.V. The crystal structure of Ca Ge2 O5 -a germanium analog of sphene Doklady Akademii Nauk SSSR 246 (1979) 1123-1126 Space group: P 1 Cell volume: 180.495 Cell parameters: 5.416; 5.517; 6.858; 104.89; 102.05; 106.8;

COD ID: 1530575
CIF file	Formula: - Pb4 S13 Sb6 - Comments: Petrova, I.V.; Belov, N.V.; Bortnikov, N.S.; Pobedimskaya, E.A.; Kaplunnik, L.N. The crystal structure of synthetic robinsonite Doklady Akademii Nauk SSSR 241 (1978) 88-90 Space group: P 1 Cell volume: 1150.41 Cell parameters: 16.56; 17.69; 3.982; 91.09; 96.46; 96.77;

COD ID: 1530579
CIF file	Formula: - Ca2 H K2 Na O20 Si7 Ti - Comments: Petrunina, A.A.; Ilyukhin, V.V.; Belov, N.V. The crystal structure of tinaksite Na K2 Ca2 Ti Si7 O19 (O H) Doklady Akademii Nauk SSSR 198 (1971) 575-578 Space group: P 1 Cell volume: 875.162 Cell parameters: 10.35; 12.17; 7.05; 91; 99.33; 92.5;

COD ID: 1530758
CIF file	Formula: - Ce4 H18 Na2 O24 Si2 Ti2 - Comments: Shumyatskaya, N.G.; Voronkov, A.A.; Ilyukhin, V.V.; Belov, N.V. Crystal structure of tundrite Doklady Akademii Nauk SSSR 185 (1969) 1289-1292 Space group: P 1 Cell volume: 486.368 Cell parameters: 7.57; 13.98; 5.03; 101.5; 70.417; 101.5;

COD ID: 1530810
CIF file	Formula: - Al H16 I3 O17 - Comments: Sorokina, N.I.; Ilyukhin, V.V.; Kalinin, V.R.; Belov, N.V. The crystal structure of aluminium iodate octahydrate Doklady Akademii Nauk SSSR 247 (1979) 360-363 Space group: P 1 Cell volume: 761.563 Cell parameters: 7.473; 8.392; 13.574; 89.93; 87.62; 63.58;

COD ID: 1530953

CIF file

Formula: - Ge2 La2 O7 -
Comments: Vetter, G.; Queyroux, F. Determination structurale de la forme de haute temperature du compose La4 (Ge3 O10) (Ge O4): Analyse comparative des structures tricliniques des germanates de terres rares de formule globale Ln2 Ge2 O7 Journal of Solid State Chemistry 73 (1988) 287-297
Space group: P 1
Cell volume: 313.312
Cell parameters: 7.08; 7.101; 6.928; 87.74; 91.25; 115.81;

COD ID: 1531039
CIF file	Formula: - C70.45 H104.45 Cl13.38 N8 O12.05 - Comments: Rodríguez-Vázquez, Nuria; García-Fandiño, Rebeca; Amorín, Manuel; Granja, Juan R. Self-assembling α,γ-cyclic peptides that generate cavities with tunable properties Chem. Sci. 7(1) (2016) 183 Space group: P 1 Cell volume: 8577.5 Cell parameters: 14.3767; 24.3477; 24.5528; 90.131; 93.427; 91.09;

COD ID: 1531687
CIF file	Formula: - H28 Na7 O38 V W6 - Comments: Kin'ones, S.O.; Kaziev, G.Z.; Volodina, V.A.; Zavodnik, V.E.; de Ita, A.; Bel'skii, V.K. Synthesis and study of sodium hexatungstovanadate(V) Zhurnal Neorganicheskoi Khimii 46 (2001) 1076-1080 Space group: P 1 Cell volume: 847.506 Cell parameters: 7.997; 11.146; 11.328; 60.89; 73.96; 83.62;

COD ID: 1531993
CIF file	Formula: - Al H4 O6 P - Comments: Poulet, G.; Sautet, P.; Tuel, A. Structure of hydrated microporous aluminophosphates: static and molecular dynamics approaches of (Al P O4)-34 from first principlescalculations J. Phys. Chem. B 106 (2002) 8599-8608 Space group: P 1 Cell volume: 798.953 Cell parameters: 9.1851; 9.464; 9.5281; 94.511; 102.89; 95.751;

COD ID: 1532192
CIF file	Formula: - Al2 Ca H8 O20 Si6 - Comments: Tanaka, T.; Kimura, R.; Akizuki, M.; Kudoh, Y. Origin of low-symmetry growth sectors in edingtonite and yugawaralite, and crystal structure of the k(011) and v(120) sectors of yugawaralite Mineralogical Magazine (1969-) 66 (2002) 409-420 Space group: P 1 Cell volume: 878.042 Cell parameters: 6.71; 13.985; 10.032; 89.96; 111.14; 90.01;

COD ID: 1533364

CIF file

Formula: - C70 Sm2.78 -
Comments: Chi Dam Hieu; Iwasa, Y.; Uehara, K.; Ohishi, Y.; Kato, K.; Takenobu, T.; Takata, M.; Nishibori, E.; Mitani, T.; Sakata, M.; Ito, T.; Kubozono, Y. Pressure-induced structural phase transition in fullerides doped with rare-earth metals Physical Review, Serie 3. B - Condensed Matter (18,1978-) 67 (2003) 094101-1-094101-9
Space group: P 1
Cell volume: 1475.13
Cell parameters: 14.408; 9.723; 10.592; 90; 96.205; 90;

COD ID: 1533461
CIF file	Formula: - C5 H22 Cl N10 Np O12 - Comments: Grigor'ev, M.S.; Antipin, M.Yu.; Garnov, A.Yu.; Krot, N.N. Synthesis and structure of complexes of Np(V) perchlorate and Np(V) chloride with urea Radiokhimiya 44 (2002) 415-419 Space group: P 1 Cell volume: 1052.15 Cell parameters: 9.134; 10.748; 11.762; 114.32; 90.33; 90.46;

COD ID: 1534438
CIF file	Formula: - Cl7 Fe Se - Comments: Rybakov, V.B.; Aslanov, L.A.; Volkov, S.V.; Fokina, Z.A.; Timoshchenko, N.I. X-ray investigation of iron(III) halogenchalcogenide complexes Zhurnal Neorganicheskoi Khimii 36 (1991) 2541-2548 Space group: P 1 Cell volume: 500.799 Cell parameters: 6.385; 8.242; 9.83; 85.91; 102.62; 96.7;

COD ID: 1534442
CIF file	Formula: - Cl7 Fe Te - Comments: Rybakov, V.B.; Aslanov, L.A.; Timoshchenko, N.I.; Volkov, S.V.; Fokina, Z.A. X-ray investigation of iron(III) halogenchalcogenide complexes Zhurnal Neorganicheskoi Khimii 36 (1991) 2541-2548 Space group: P 1 Cell volume: 528.266 Cell parameters: 6.539; 8.388; 9.966; 86.12; 102.72; 97.46;

COD ID: 1534445
CIF file	Formula: - Br7 Fe Te - Comments: Rybakov, V.B.; Aslanov, L.A.; Fokina, Z.A.; Volkov, S.V.; Timoshchenko, N.I. X-ray investigation of iron(III) halogenchalcogenide complexes Zhurnal Neorganicheskoi Khimii 36 (1991) 2541-2548 Space group: P 1 Cell volume: 601.478 Cell parameters: 6.796; 8.769; 10.435; 85.71; 102.63; 97.06;

COD ID: 1534661
CIF file	Formula: - H0.5 Na5.5 O22 P4 U3 - Comments: Gorbunova, Yu.E.; Linde, S.A.; Lavrov, A.V.; Pobedina, A.B. Synthesis and structure of Na6-x(UO2)3(HxPO4)(PO4)3 (x=0.5) Doklady Akademii Nauk SSSR 251 (1980) 385-389 Space group: P 1 Cell volume: 488.65 Cell parameters: 6.675; 6.922; 10.732; 83.96; 82.29; 89.44;

COD ID: 1534803
CIF file	Formula: - Ba3 O6 W - Comments: Balashov, V.L.; Kharlanov, A.A.; Kondratov, O.I.; Fomichev, V.V. Model of crystal structure and analysis of oscillation in Ba3WO6 Zhurnal Neorganicheskoi Khimii 36 (1991) 456-459 Space group: P 1 Cell volume: 323.405 Cell parameters: 6.1072; 6.1071; 8.671; 90.02; 89.98; 90.04;

COD ID: 1535346
CIF file	Formula: - Cs10 K6 Pb36 - Comments: Bobev, S.; Sevov, S.C. Isolated Deltahedral Clusters of Lead in the Solid State: Synthesis and Characterization of Rb4Pb9 and Cs10K6Pb36 with Pb94-, and A3A'Pb4 (A = Cs, Rb, K; A' = Na, Li) with Pb44- Polyhedron 21 (2002) 641-649 Space group: P 1 Cell volume: 2140.71 Cell parameters: 9.843; 15.155; 15.289; 104.51; 97.63; 99.55;

COD ID: 1535858

CIF file

Formula: - C6 H2 K3 N9 O -
Comments: Irran, E.; Juergens, B.; Schnick, W. Synthesis, crystal structure determination from X-ray powder diffractometry and vibrational spectroscopy of the tricyanomelaminate monohydrates M3 (C6 H9) * (H2 O) (M = K, Rb) Solid State Sciences 4 (2002) 1305-1311
Space group: P 1
Cell volume: 285.216
Cell parameters: 3.72911; 8.092; 10.1222; 71.2085; 80.5242; 86.6534;

COD ID: 1535862

CIF file

Formula: - C6 H2 N9 O Rb3 -
Comments: Irran, E.; Juergens, B.; Schnick, W. Synthesis, crystal structure determination from X-ray powder diffractometry and vibrational spectroscopy of the tricyanomelaminate monohydrates M3 (C6 H9) * (H2 O) (M = K, Rb) Solid State Sciences 4 (2002) 1305-1311
Space group: P 1
Cell volume: 314.803
Cell parameters: 3.93168; 8.26477; 10.36279; 70.7984; 81.8717; 87.5042;

COD ID: 1535873
CIF file	Formula: - Cl3 H16 Mg N O6 - Comments: Nakayasu, M.; Suzukawa, Y.; Kobayashi, W. Crystal structure of Mg Cl2 * (N H4) Cl * (H2 O)6 Denki Kagaku Oyobi Kogyo Butsuri Kagaku (= Electro-Chemistry and Industrial Physical-Chemistry) 51 (1983) 419-422 Space group: P 1 Cell volume: 590.652 Cell parameters: 6.665; 13.301; 6.665; 89.92; 91.52; 89.99;

COD ID: 1536384
CIF file	Formula: - Cl4 Cs2 Hg - Comments: Pakhomov, V.I.; Goryunov, A.V.; Gladkii, V.V.; Kallaev, S.N.; Ivanova-Korfini, I.N. Structure of low temperature (170 K) phase and piezoelectric properties of cesium tetrachloromercurate. Zhurnal Neorganicheskoi Khimii 37 (1992) 1447-1454 Space group: P 1 Cell volume: 1956.07 Cell parameters: 7.519; 9.722; 26.759; 89.97; 90.1; 90.11;

COD ID: 1536389
CIF file	Formula: - O2 Si - Comments: Pakhomov, V.I.; Goryunov, A.V.; Pakhomov, P.V.; Chibiskova, N.T. On the structure of alpha-Si O2 crystals doped with Fe3+ Zhurnal Neorganicheskoi Khimii 38 (1993) 44-50 Space group: P 1 Cell volume: 113.188 Cell parameters: 4.916; 4.917; 5.407; 90; 90; 120;

COD ID: 1536429
CIF file	Formula: - Cs15 H12 La3 O78 P24 - Comments: Palkina, K.K.; Kuz'mina, N.E.; Sazhenkov, A.Yu.; Masloboev, V.A. Structure of La3 Cs15 P24 O72 6(H2 O) crystals Zhurnal Neorganicheskoi Khimii 40 (1995) 374-380 Space group: P 1 Cell volume: 2133.53 Cell parameters: 12.188; 14.74; 14.847; 60.87; 66.35; 77.54;

COD ID: 1536545
CIF file	Formula: - H4 Na7.23 O26 P2 Si4 Ti4 - Comments: Khalilov, A.D. Refinement of crystal structure of betalomonosovite from Lovozerskii alkaline mine Mineralogiceskij Zhurnal 12 (1990) 10-18 Space group: P 1 Cell volume: 538.188 Cell parameters: 5.351; 7.131; 14.488; 102.1; 95.24; 90;

COD ID: 1536585
CIF file	Formula: - Al17 Ba45 Cu28 F197 - Comments: Dupont, N.; Gredin, P.; Samouel, M.; de Kozak, A. The ternary system (Ba F2)/(Cu F2)/(Al F3) and the crystal structure of Ba45 Cu28 Al17 F197 Zeitschrift fuer Anorganische und Allgemeine Chemie 628 (2002) 191-197 Space group: P 1 Cell volume: 8123.62 Cell parameters: 14.024; 23.778; 25.48; 90.44; 90.26; 107.03;

COD ID: 1536629
CIF file	Formula: - Mo0.97 O5 V0.95 - Comments: Plyasova, L.M.; Kryukova, G.N.; Solov'eva, L.P.; Zabolotnyi, V.A.; Olen'kova, I.P. The study of atomic structure of polycrystalline vanadium molybdate Zhurnal Strukturnoi Khimii (Issue-No. from 1981) 32 (1991) 110-115 Space group: P 1 Cell volume: 91.158 Cell parameters: 6.334; 4.0463; 3.7255; 90; 107.3; 90.5;

COD ID: 1536716
CIF file	Formula: - Ba F12 Sb2 - Comments: Popov, A.I.; Val'kovskii, M.D.; Sukhoverkhov, V.F. Structure of fluoroantimonates(V) and fluorobismuthates(V) of alkaline earth metals Zhurnal Neorganicheskoi Khimii 35 (1990) 2831-2836 Space group: P 1 Cell volume: 174.317 Cell parameters: 4.885; 5.074; 8.627; 104.7; 100.25; 116.5;

COD ID: 1536883
CIF file	Formula: - Ca4.7 Ce0.1 F2 Fe0.1 H Mn0.1 Na2 O16 Si4 Ti - Comments: Rastsvetaeva, R.K.; Pushcharovskii, D.Yu.; Atencio, D. Crystal structure of giannetite Kristallografiya 40 (1995) 626-630 Space group: P 1 Cell volume: 382.496 Cell parameters: 9.584; 7.267; 5.708; 89.85; 101.22; 101.03;

COD ID: 1536900

CIF file

Formula: - H6 O5 Sr Zn -
Comments: Zaitsev, B.E.; Ivanov-Emin, B.N.; Petrishcheva, L.P.; Il'inets, A.M.; Baturin, N.A.; Regel', L.L. IK spectrum of sodium and alkali-earth metals hydroxozincates and crystal structure of SrZn(OH)4 H2O Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)) 16 (1990) 1255-1259
Space group: P 1
Cell volume: 261.975
Cell parameters: 6.245; 6.298; 7.838; 105.39; 65.15; 108.63;

COD ID: 1539580
CIF file	Formula: - O9 Ti5 - Comments: Andersson, S. The crystal structure of Ti5 O9 Acta Chemica Scandinavica (1-27,1973-42,1988) 14 (1960) 1161-1172 Space group: P 1 Cell volume: 295.326 Cell parameters: 5.569; 7.12; 8.865; 97.55; 112.34; 108.5;

COD ID: 1539962
CIF file	Formula: - H O10 P3 Pb2 - Comments: Worzala, H.; Jost, K.H. Die Kristallstruktur des Bleimonohydrogentriphosphats, Pb2 H P3 O10 Zeitschrift fuer Anorganische und Allgemeine Chemie 445 (1978) 36-46 Space group: P 1 Cell volume: 209.486 Cell parameters: 7.77; 5.97; 6.93; 135.1; 105.8; 67.4;

COD ID: 1540608

CIF file

Formula: - C32 H37 Br Cl N3 O6 S2 -
Comments: Marsini, Maurice A.; Reeves, Jonathan T.; Desrosiers, Jean-Nicolas; Herbage, Melissa A.; Savoie, Jolaine; Li, Zhibin; Fandrick, Keith R.; Sader, C. Avery; McKibben, Bryan; Gao, Donghong A.; Cui, Jianwen; Gonnella, Nina C.; Lee, Heewon; Wei, Xudong; Roschangar, Frank; Lu, Bruce Z.; Senanayake, Chris H. Diastereoselective Synthesis of α-Quaternary Aziridine-2-carboxylates via Aza-Corey-Chaykovsky Aziridination of N-tert-Butanesulfinyl Ketimino Esters. Organic letters 17(22) (2015) 5614-5617
Space group: P 1
Cell volume: 1747.12
Cell parameters: 9.9554; 13.0776; 14.9103; 75.045; 78.893; 69.659;

COD ID: 1540626
CIF file	Formula: - C54 H78 Mo N2 O2 - Comments: Al-Khafaji, Yahya; Prior, Timothy; Elsegood, Mark; Redshaw, Carl Molybdenum (VI) Imido Complexes Derived from Chelating Phenols: Synthesis, Characterization and ɛ-Caprolactone ROP Capability Catalysts 5(4) (2015) 1928 Space group: P 1 Cell volume: 1261.15 Cell parameters: 10.0435; 10.3143; 12.8862; 74.5019; 87.313; 78.6415;

COD ID: 1540720

CIF file

Formula: - C27 H38 O4 -
Comments: Cimmino, Alessio; Mathieu, Veronique; Masi, Marco; Baroncelli, Riccardo; Boari, Angela; Pescitelli, Gennaro; Ferderin, Marlène; Lisy, Romana; Evidente, Marco; Tuzi, Angela; Zonno, Maria Chiara; Kornienko, Alexander; Kiss, Robert; Evidente, Antonio Higginsianins A and B, Two Diterpenoid α-Pyrones Produced by Colletotrichum higginsianum, with in Vitro Cytostatic Activity. Journal of natural products 79(1) (2016) 116-125
Space group: P 1
Cell volume: 1332
Cell parameters: 7.234; 10.321; 19.308; 85.37; 79.85; 69.87;

COD ID: 1540955
CIF file	Formula: - As K Se2 - Comments: Sheldrick, W.S.; Haeusler, H.J. Zur Kenntnis von Alkalimetaselenoarseniten. Darstellung und Kristallstrukturen von M As Se2, M = K, Rb, Cs Zeitschrift fuer Anorganische und Allgemeine Chemie 561 (1988) 139-148 Space group: P 1 Cell volume: 492.567 Cell parameters: 6.558; 12.628; 6.554; 100.43; 107.53; 100.48;

COD ID: 1541620
CIF file	Formula: - Ca2 F Na O8 Si2 Ti - Comments: Kheirov, M.B.; Mamedov, Kh.S.; Belov, N.V. Crystal structure of rinkite Na (Ca, Ce)2 (Ti, Ce) O (Si2 O7) F Doklady Akademii Nauk SSSR 150 (1963) 162-164 Space group: P 1 Cell volume: 786.292 Cell parameters: 18.9; 7.47; 5.68; 90; 90; 101.33;

COD ID: 1541907
CIF file	Formula: - C55 H82 N2 O8 S - Comments: Nuthanakanti, Ashok; Srivatsan, Seergazhi G. Hierarchical self-assembly of switchable nucleolipid supramolecular gels based on environmentally-sensitive fluorescent nucleoside analogs. Nanoscale 8(6) (2016) 3607-3619 Space group: P 1 Cell volume: 1273 Cell parameters: 5.385; 9.274; 25.69; 92.65; 95.509; 93.348;

COD ID: 1541908
CIF file	Formula: - C51 H74 N2 O8 S - Comments: Nuthanakanti, Ashok; Srivatsan, Seergazhi G. Hierarchical self-assembly of switchable nucleolipid supramolecular gels based on environmentally-sensitive fluorescent nucleoside analogs. Nanoscale 8(6) (2016) 3607-3619 Space group: P 1 Cell volume: 1204.23 Cell parameters: 5.4174; 9.3296; 24.033; 95.858; 92.994; 93.33;

COD ID: 1541909
CIF file	Formula: - C50.5 H79.5 N2.5 O9.5 - Comments: Nuthanakanti, Ashok; Srivatsan, Seergazhi G. Hierarchical self-assembly of switchable nucleolipid supramolecular gels based on environmentally-sensitive fluorescent nucleoside analogs. Nanoscale 8(6) (2016) 3607-3619 Space group: P 1 Cell volume: 2454 Cell parameters: 8.671; 11.183; 27.36; 94.389; 97.977; 109.553;

COD ID: 1541910
CIF file	Formula: - C46.5 H71.5 N2.5 O9.5 - Comments: Nuthanakanti, Ashok; Srivatsan, Seergazhi G. Hierarchical self-assembly of switchable nucleolipid supramolecular gels based on environmentally-sensitive fluorescent nucleoside analogs. Nanoscale 8(6) (2016) 3607-3619 Space group: P 1 Cell volume: 2229.9 Cell parameters: 8.615; 11.124; 25.315; 101.343; 91.424; 109.601;

COD ID: 1542283

CIF file

Formula: - C12 H26 In2 O6 -
Comments: Horeglad, P.; Cybularczyk, M.; Litwińska, A.; Dąbrowska, A. M.; Dranka, M.; Żukowska, G. Z.; Urbańczyk, M.; Michalak, M. Controlling the stereoselectivity of rac-LA polymerization by chiral recognition induced the formation of homochiral dimeric metal alkoxides Polym. Chem. 7(11) (2016) 2022
Space group: P 1
Cell volume: 471.36
Cell parameters: 6.9927; 8.3025; 8.4128; 76.086; 83.924; 87.628;

COD ID: 1542333
CIF file	Formula: - C32 H32 O6 P2 - Comments: Bigler, Raphael; Mezzetti, Antonio Highly Enantioselective Transfer Hydrogenation of Polar Double Bonds by Macrocyclic Iron(II)/(NH)2P2Catalysts Organic Process Research & Development 20(2) (2016) 253 Space group: P 1 Cell volume: 677.2 Cell parameters: 8.4358; 8.6021; 9.8323; 104.212; 98.226; 96.026;

COD ID: 1542352

CIF file

Formula: - C52 H72 N4 O19 -
Comments: Widlicka, Daniel W.; Murray, John C.; Coffman, Karen J.; Xiao, Chunguang; Brodney, Michael A.; Rainville, Joseph P.; Samas, Brian Two Routes to 4-Fluorobenzisoxazol-3-one in the Synthesis of a 5-HT4Partial Agonist Organic Process Research & Development 20(2) (2016) 233
Space group: P 1
Cell volume: 2558.26
Cell parameters: 11.4197; 15.8645; 16.2611; 66.72; 86.95; 71.548;

COD ID: 1542484
CIF file HKL data	Formula: - C14 H28 N2 O8 S2 - Comments: Nageshwari, M.; Kumaresan, S.; Caroline, M. Lydia; Mani, G.; Kumari, C. Rathika Thaya; Sudha, S.; Jayaprakash, P. <small>L</small>-Methionine‒succinic acid (2/1) IUCrData 1(1) (2016) x152459 Space group: P 1 Cell volume: 491.08 Cell parameters: 5.0283; 5.058; 20.8394; 86.645; 83.338; 68.908;

COD ID: 1542538

CIF file

Formula: - C24 H32 F6 N8 O6 S2 Zn -
Comments: Comerford, James W.; Hart, Sam J.; North, Michael; Whitwood, Adrian C. Homogeneous and silica-supported zinc complexes for the synthesis of propylene carbonate from propane-1,2-diol and carbon dioxide Catal. Sci. Technol. 6(13) (2016) 4824
Space group: P 1
Cell volume: 785.04
Cell parameters: 8.3731; 8.6907; 11.7281; 68.851; 81.968; 82.401;

COD ID: 1542542

CIF file

HKL data

Original IUCr paper

Formula: - C16 H22 N2 O7 -
Comments: Numata, Takashi; Ikenomoto, Shun; Akitsu, Takashiro 4,4'-(1,2-Diazaniumylethane-1,2-diyl)dibenzoate trihydrate IUCrData 1(2) (2016) x160252
Space group: P 1
Cell volume: 413.7
Cell parameters: 6.778; 6.953; 9.458; 109.182; 93.369; 98.437;

COD ID: 1542570

CIF file

Formula: - C13 H10 Cl N O2 -
Comments: Sanchez-Diez, Eduardo; Vesga, Diana L.; Reyes, Efraim; Uria, Uxue; Carrillo, Luisa; Vicario, Jose L. Organocatalytically Generated Donor-Acceptor Cyclopropanes in Domino Reactions. One-Step Enantioselective Synthesis of Pyrrolo[1,2-a]quinolines. Organic letters 18(6) (2016) 1270-1273
Space group: P 1
Cell volume: 542.58
Cell parameters: 7.02512; 8.17982; 10.0807; 104.135; 104.019; 91.6954;

COD ID: 1542738
CIF file	Formula: - C14 H6 N2 O2 - Comments: Fratini, Albert V.; Cross, Elisa M.; O'brien, Joseph F.; Adams, W. Wade The structure of poly-2,5-benzoxazole (ABPBO) and poly-2,6-benzothiazole (ABPBT) fibers by X-ray diffraction Journal of Macromolecular Science, Part B 24(1-4) (1985) 159-179 Space group: P 1 Cell volume: 237.4 Cell parameters: 6.061; 3.384; 11.575; 90; 90; 90;

COD ID: 1542739
CIF file	Formula: - C14 H6 N2 S2 - Comments: Fratini, Albert V.; Cross, Elisa M.; O'brien, Joseph F.; Adams, W. Wade The structure of poly-2,5-benzoxazole (ABPBO) and poly-2,6-benzothiazole (ABPBT) fibers by X-ray diffraction Journal of Macromolecular Science, Part B 24(1-4) (1985) 159-179 Space group: P 1 Cell volume: 251.8 Cell parameters: 6.044; 3.417; 12.194; 90; 90; 90;

COD ID: 1542862

CIF file

Formula: - C19 H20 Cl2 Cu N4 O9 -
Comments: Hallett, Andrew J.; O'Brien, Thomas M.; Carter, Emma; Kariuki, Benson M.; Murphy, Damien M.; Ward, Benjamin D. Copper(II) complexes of pyridine-oxazoline (Pyox) ligands: Coordination chemistry, ligand stability, and catalysis Inorganica Chimica Acta 441 (2016) 86-94
Space group: P 1
Cell volume: 1178.7
Cell parameters: 8.8284; 10.076; 14.925; 76.39; 78.81; 66.84;

COD ID: 1542911

CIF file

Formula: - C21 H17 N O7 -
Comments: Osorio-Planes, Laura; Rodríguez-Escrich, Carles; Pericàs, Miquel A. Removing the superfluous: a supported squaramide catalyst with a minimalistic linker applied to the enantioselective flow synthesis of pyranonaphthoquinones Catal. Sci. Technol. 6(13) (2016) 4686
Space group: P 1
Cell volume: 900.55
Cell parameters: 8.914; 10.559; 10.6874; 82.779; 72.066; 70.261;

COD ID: 1543030
CIF file	Formula: - C10 H12 B N O4 S - Comments: Bandyopadhyay, Anupam; Cambray, Samantha; Gao, Jianmin Fast and selective labeling of N-terminal cysteines at neutral pH via thiazolidino boronate formation. Chemical science 7(7) (2016) 4589-4593 Space group: P 1 Cell volume: 548.43 Cell parameters: 5.8323; 6.989; 13.7431; 97.28; 98.85; 91.576;

COD ID: 1543066

CIF file

HKL data

Original IUCr paper

Formula: - C18 H26 Cl2 N2 O -
Comments: Benharref, Ahmed; Oukhrib, Abdelouhed; Ait Elhad, Mustapha; Daran, Jean-Claude; Berraho, Moha N'-[(1S,3R,8R)-2,2-Dichloro-3,7,7,10-tetramethyltricyclo[6.4.0.0^1,3^]dodecan-11-yl]acetohydrazide IUCrData 1(4) (2016) x160554
Space group: P 1
Cell volume: 938.73
Cell parameters: 9.9172; 10.001; 10.4124; 86.863; 84.173; 66.037;

COD ID: 1543124
CIF file	Formula: - C29 H21 Br N2 O3 S - Comments: Hu, Zhiyong; Tong, Xiaofeng; Liu, Guixia Rhodium(III)-Catalyzed Cascade Cyclization/Electrophilic Amidation for the Synthesis of 3-Amidoindoles and 3-Amidofurans. Organic letters 18(9) (2016) 2058-2061 Space group: P 1 Cell volume: 1255.1 Cell parameters: 9.8056; 10.1342; 13.2604; 106.4; 94.409; 93.758;

COD ID: 1543218

CIF file

Formula: - C22 H23 N O5 -
Comments: El Bouakher, Abderrahman; Le Goff, Ronan; Tasserie, Jordan; Lhoste, Jérôme; Martel, Arnaud; Comesse, Sébastien Synthesis of Oxazolidin-4-ones: Domino O-Alkylation/Aza-Michael/Intramolecular Retro-Claisen Condensation. Organic letters 18(10) (2016) 2383-2386
Space group: P 1
Cell volume: 1471.6
Cell parameters: 7.8503; 11.0271; 17.767; 75.302; 81.673; 89.125;

COD ID: 1543317
CIF file	Formula: - C24 H19 Br N2 O2 S - Comments: Kikuchi, Jun; Momiyama, Norie; Terada, Masahiro Chiral Phosphoric Acid Catalyzed Diastereo- and Enantioselective Mannich-Type Reaction between Enamides and Thiazolones. Organic letters 18(11) (2016) 2521-2523 Space group: P 1 Cell volume: 1650.25 Cell parameters: 11.3141; 13.0066; 13.3059; 107.027; 97.7315; 113.173;

COD ID: 1543335

CIF file

Formula: - C18 H17 N O6 -
Comments: Yu, Xuelong; Guo, Qiang; Su, Guozhu; Yang, Ailin; Hu, Zhongdong; Qu, Changhai; Wan, Zhe; Li, Ruoyu; Tu, Pengfei; Chai, Xingyun Usnic Acid Derivatives with Cytotoxic and Antifungal Activities from the Lichen Usnea longissima. Journal of natural products 79(5) (2016) 1373-1380
Space group: P 1
Cell volume: 1650.2
Cell parameters: 17.138; 9.7525; 13.831; 90; 134.45; 90;

COD ID: 1543336

CIF file

Formula: - C20 H23 N O7 -
Comments: Yu, Xuelong; Guo, Qiang; Su, Guozhu; Yang, Ailin; Hu, Zhongdong; Qu, Changhai; Wan, Zhe; Li, Ruoyu; Tu, Pengfei; Chai, Xingyun Usnic Acid Derivatives with Cytotoxic and Antifungal Activities from the Lichen Usnea longissima. Journal of natural products 79(5) (2016) 1373-1380
Space group: P 1
Cell volume: 1965.14
Cell parameters: 11.6293; 9.9961; 16.9428; 90; 93.84; 90;

COD ID: 1543356
CIF file	Formula: - C29 H22 O4 - Comments: Aida, Yukimasa; Sugiyama, Haruki; Uekusa, Hidehiro; Shibata, Yu; Tanaka, Ken Rhodium-Catalyzed Asymmetric [2 + 2 + 2] Cycloaddition of α,ω-Diynes with Unsymmetrical 1,2-Disubstituted Alkenes. Organic letters 18(11) (2016) 2672-2675 Space group: P 1 Cell volume: 545.829 Cell parameters: 5.105; 9.985; 11.8359; 65.909; 85.15; 82.591;

COD ID: 1543772

CIF file

Formula: - C40 H34 N4 O2 -
Comments: Tian, Xiaohe; Zhang, Qiong; Zhang, Mingzhu; Uvdal, Kajsa; Wang, Qin; Chen, Junyang; Du, Wei; Huang, Bei; Wu, Jieying; Tian, Yupeng Probe for simultaneous membrane and nucleus labeling in living cells and in vivo bioimaging using a two-photon absorption water-soluble Zn(ii) terpyridine complex with a reduced π-conjugation system. Chemical science 8(1) (2017) 142-149
Space group: P 1
Cell volume: 814.7
Cell parameters: 5.559; 11.24; 13.638; 75.767; 83.93; 81.445;

COD ID: 1543791

CIF file

Formula: - C56 H68 Cl F14 N7 O2 S2 -
Comments: Lehnherr, Dan; Ford, David D.; Bendelsmith, Andrew J.; Kennedy, C. Rose; Jacobsen, Eric N. Conformational Control of Chiral Amido-Thiourea Catalysts Enables Improved Activity and Enantioselectivity. Organic letters 18(13) (2016) 3214-3217
Space group: P 1
Cell volume: 3135.3
Cell parameters: 9.7657; 12.7259; 26.975; 86.183; 83.556; 70.327;

COD ID: 1543829
CIF file	Formula: - C26 H32 O5 - Comments: Liu, Cui-Ping; Wang, Guo-Cai; Gan, Li-She; Xu, Cheng-Hui; Liu, Qun-Fang; Ding, Jian; Yue, Jian-Min Ciliatonoids A and B, Two Limonoids from Toona ciliata. Organic letters 18(12) (2016) 2894-2897 Space group: P 1 Cell volume: 1076.14 Cell parameters: 7.2748; 12.323; 13.1676; 114.212; 90.277; 91.395;

COD ID: 1544035
CIF file	Formula: - C20 H14 N4 O2 S2 - Comments: Alpugan, Serkan; Ekineker, Gülçin; Ahsen, Vefa; Berber, Savaş; Önal, Emel; Dumoulin, Fabienne Bisphthalonitrile with a Disulfide-Based Linker and its Dimethylene Analogue: Comparative Structural Insights Crystals 6(8) (2016) 89 Space group: P 1 Cell volume: 488.84 Cell parameters: 5.3047; 9.4281; 10.3733; 73.857; 79.443; 83.488;

COD ID: 1544242

CIF file

Formula: - C16 H17 N O2 -
Comments: Maeda, Hajime; Takenaka, Hiroki; Mizuno, Kazuhiko Intermolecular hydrogen bonding controlled stereoselective photocycloaddition of vinyl ethers to 1-cyanonaphthalenes. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 15(11) (2016) 1385-1392
Space group: P 1
Cell volume: 1349.9
Cell parameters: 8.164; 8.507; 19.437; 90.22; 90.11; 90.19;

COD ID: 1544495
CIF file	Formula: - Ca0.47 Co O2 - Comments: Miyazaki, Y.; Huang, X.; Kajiwara, T.; Yamane, H.; Kajitani, T. Synthesis, crystal structure and physical properties of layered cobalt oxide CaxCoO2 (x~0.47) Journal of the Ceramic Society of Japan 117 (2009) 42-46 Space group: P 1 Cell volume: 152.04 Cell parameters: 4.924; 5.683; 5.685; 75.4; 89.974; 81.261;

COD ID: 1544941
CIF file	Formula: - C26 H28 Cl2 O8 S2 - Comments: Wallbaum, Jan; Garve, Lennart K. B.; Jones, Peter G.; Werz, Daniel B. Ring-Opening 1,3-Halochalcogenation of Cyclopropane Dicarboxylates. Organic letters 19(1) (2017) 98-101 Space group: P 1 Cell volume: 715.11 Cell parameters: 7.5065; 8.2625; 12.1071; 93.086; 105.999; 96.045;

COD ID: 1545020
CIF file	Formula: - C22 H22 O5 - Comments: Fu, Kai; Zhang, Jingchuan; Lin, Lili; Li, Jun; Liu, Xiaohua; Feng, Xiaoming Chiral N,N′-Dioxide/Lanthanide(III) Complex Catalyzed Asymmetric Bisvinylogous Mukaiyama Aldol Reactions Organic Letters (2017) Space group: P 1 Cell volume: 942.61 Cell parameters: 5.5512; 8.9374; 19.4754; 102.143; 93.557; 90.362;

COD ID: 1545029
CIF file	Formula: - C20 H24 N O5.5 P - Comments: Suneja, Arun; Unhale, Rajshekhar A.; Singh, Vinod K. Enantioselective Hydrophosphonylation of in Situ Generated N-Acyl Ketimines Catalyzed by BINOL-Derived Phosphoric Acid. Organic letters 19(3) (2017) 476-479 Space group: P 1 Cell volume: 1981.1 Cell parameters: 8.8456; 13.4959; 17.587; 92.181; 98.685; 106.652;

COD ID: 1545091
CIF file	Formula: - C18 H17 F5 N O5 P - Comments: McCabe Dunn, Jamie M.; Reibarkh, Mikhail; Sherer, Edward C.; Orr, Robert K.; Ruck, Rebecca T.; Simmons, Bryon; Bellomo, Ana The protecting-group free selective 3′-functionalization of nucleosides Chem. Sci. 8(4) (2017) 2804 Space group: P 1 Cell volume: 980.85 Cell parameters: 5.2533; 12.0015; 16.3874; 74.879; 84.088; 80.148;

COD ID: 1545093
CIF file	Formula: - C54 H51 Cl O2 Ru - Comments: Kossler, D.; Cramer, N. Neutral chiral cyclopentadienyl Ru(ii)Cl catalysts enable enantioselective [2+2]-cycloadditions Chem. Sci. 8(3) (2017) 1862 Space group: P 1 Cell volume: 2074.99 Cell parameters: 10.9092; 12.5543; 15.2599; 86.71; 83.989; 89.249;

COD ID: 1545162

CIF file

Formula: - C53 H90 N10 O11 -
Comments: Tomsett, Michael; Maffucci, Irene; Le Bailly, Bryden A. F.; Byrne, Liam; Bijvoets, Stefan M.; Lizio, M. Giovanna; Raftery, James; Butts, Craig P.; Webb, Simon J.; Contini, Alessandro; Clayden, Jonathan A tendril perversion in a helical oligomer: trapping and characterizing a mobile screw-sense reversal. Chemical science 8(4) (2017) 3007-3018
Space group: P 1
Cell volume: 1452.19
Cell parameters: 9.302; 9.7698; 16.9249; 84.505; 86.765; 71.597;

COD ID: 1545180
CIF file	Formula: - C10 H15.5 N4 O6.75 S - Comments: Rovira, Alexander R.; Fin, Andrea; Tor, Yitzhak Expanding a fluorescent RNA alphabet: synthesis, photophysics and utility of isothiazole-derived purine nucleoside surrogates. Chemical science 8(4) (2017) 2983-2993 Space group: P 1 Cell volume: 1337.78 Cell parameters: 8.0883; 10.9716; 16.0771; 72.07; 80.273; 86.279;

COD ID: 1545299

CIF file

Formula: - C23 H24 Cl2 Co N5 O2 P -
Comments: Chen, Huafeng; Pan, Weijing; Huang, Kuo-Wei; Zhang, Xuequan; Gong, Dirong Controlled polymerization of isoprene promoted by a type of hemilabile XPN3 (X = O, S) ligand supported cobalt(ii) complexes: the role of a hemilabile donor on the level of control Polym. Chem. 8(11) (2017) 1805
Space group: P 1
Cell volume: 619
Cell parameters: 7.881; 8.61; 10.582; 101.612; 110.925; 103.559;

COD ID: 1545431

CIF file

Formula: - C11 H9.5 F1.5 O2 S -
Comments: Zhao, Bo-Liang; Du, Da-Ming Enantioselective Squaramide-Catalyzed Trifluoromethylthiolation-Sulfur-Michael/Aldol Cascade Reaction: One-Pot Synthesis of CF3S-Containing Spiro Cyclopentanone-Thiochromanes. Organic letters 19(5) (2017) 1036-1039
Space group: P 1
Cell volume: 1044.6
Cell parameters: 9.239; 9.369; 13.014; 69.214; 85.843; 82.923;

COD ID: 1545571

CIF file

Formula: - C63 H101 O23 -
Comments: Wang, Luo-Yi; Qin, Jun-Jun; Chen, Zhen-Hua; Zhou, Yu; Tang, Wei; Zuo, Jian-Ping; Zhao, Wei-Min Absolute Configuration of Periplosides C and F and Isolation of Minor Spiro-orthoester Group-Containing Pregnane-type Steroidal Glycosides from Periploca sepium and Their T-Lymphocyte Proliferation Inhibitory Activities. Journal of natural products 80(4) (2017) 1102-1109
Space group: P 1
Cell volume: 1668.16
Cell parameters: 11.5223; 11.5593; 14.854; 109.544; 94.088; 113.055;

COD ID: 1545773
CIF file	Formula: - C22 H19 F3 O3 - Comments: Zhang, Junliang; Zhou, Wei; Wang, Hua-Min; Tao, Mengna; Zhu, Chao-Ze; Lin, Tao-Yan Phosphine-catalyzed Enantioselective [3+2] Cycloadditions of -Substituted Allenoates with β-Perfluoroalkyl Enones Chem. Sci. (2017) Space group: P 1 Cell volume: 945.24 Cell parameters: 8.7678; 10.7305; 10.8657; 67.757; 88.911; 87.411;

COD ID: 1545887
CIF file	Formula: - C28 H28 N2 O10 - Comments: Schneider, Lisa M.; Schmiedel, Volker M.; Pecchioli, Tommaso; Lentz, Dieter; Merten, Christian; Christmann, Mathias Asymmetric Synthesis of Carbocyclic Propellanes. Organic letters (2017) Space group: P 1 Cell volume: 1263.48 Cell parameters: 7.3394; 12.4108; 14.7998; 107.312; 100.068; 91.14;

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