Crystallography Open Database
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Searching space group like 'P 1'
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
---|---|---|---|---|---|---|
1000459 | CIF | C H22 Al2 Ca4 O20 | P 1 | 5.7747; 8.4689; 9.923 64.77; 82.75; 81.43 | 433 | Francois, M; Renaudin, G; Evrard, O A cementitious compound with composition 3CaO . Al2O3 . CaCO3 . 11H2O Acta Crystallographica C (39,1983-), 1998, 54, 1214-1217 |
1001844 | CIF | F12 H2 Np3 O | P 1 | 8.455; 8.858; 8.396 113.83; 116.64; 58.03 | 465.2 | Cousson, A; Abazli, H; Pages, M; Gasperin, M Tetrafluorure de Neptunium Hydrate, Np3 F12 1. 1H H2 O Acta Crystallographica C (39,1983-), 1983, 39, 425-427 |
1004039 | CIF | B Cl4 K O12 S4 | P 1 | 10.513; 10.838; 10.965 99.21; 135.48; 97.15 | 811.7 | Mairesse, G; Drache, M The crystal structure of potassium tetrachlorosulfatoborate, K (B (S O~3~ Cl)~4~) Acta Crystallographica B (24,1968-38,1982), 1978, 34, 1771-1776 |
1007093 | CIF | Ce H8 N2 O15 P5 | P 1 | 7.241; 13.314; 7.241 90.35; 107.5; 90.28 | 665.7 | 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, 1983, 50, 240-246 |
1007133 | CIF | Ce O14 P5 | P 1 | 9.227; 8.89; 7.219 110.12; 102.68; 82.13 | 541.2 | 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, 1984, 52, 61-65 |
1007208 | CIF | H2 K7 N O22 P6 | P 1 | 9.7; 9.749; 6.543 107.23; 106.37; 75.88 | 558.3 | 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, 1992, 29, 1161-1172 |
1010563 | CIF | Al Cl3 | P 1 | 3.475; 3.475; 8.51 90; 90; 120 | 89 | Laschkarew, W E Zur Struktur Al Cl~3~ Zeitschrift fuer Anorganische und Allgemeine Chemie, 1930, 193, 270-276 |
1100201 | CIF | C14 H12 Cl2 O S | P 1 | 9.018; 9.6771; 9.974 71.564; 62.985; 62.938 | 683.92 | Hoffmann, Reinhard W.; Nell, Peter G.; Leo, Roland; Harms, Klaus Highly Enantiomerically Enriched α-Haloalkyl Grignard Reagents Chemistry - A European Journal, 2000, 6, 3359-3365 |
1100202 | CIF | C14 H12 Br Cl O S | P 1 | 9.1121; 9.7596; 9.9764 84.681; 62.893; 63.397 | 699.198 | Hoffmann, Reinhard W.; Nell, Peter G.; Leo, Roland; Harms, Klaus Highly Enantiomerically Enriched α-Haloalkyl Grignard Reagents Chemistry - A European Journal, 2000, 6, 3359-3365 |
1100269 | CIF | C54 H82 N9 O6.5 | P 1 | 9.3553; 15.9882; 19.585 103.119; 90.298; 102.334 | 2782.6 | 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), 2002, 782-783 |
1100342 | CIF | C39 H52 B N O9 | P 1 | 10.938; 13.923; 14.477 101.16; 109.52; 104.29 | 1919.53 | Reetz, Manfred T.; Niemeyer, Christof M.; Harms, Klaus Heterotopic Host Molecules for Binding Two Different Guests Angewandte Chemie, International Edition in English, 1991, 30, 1474-1476 |
1100404 | CIF | C26 H27 Li O2 | P 1 | 11.05; 11.561; 19.302 96.94; 93; 115.58 | 2192.74 | 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, 1995, 457-460 |
1100503 | CIF | C27 H25 N O2 | P 1 | 8.766; 9.673; 12.647 81.71; 82.07; 78.91 | 1034.63 | 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), 1999, 2353-2365 |
1100594 | CIF | C36 H33 B V3 | P 1 | 7.796; 12.429; 14.599 98.94; 94.67; 93.15 | 1389.48 | 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, 1999, 2173-2185 |
1100692 | CIF | Bi2 K6 O21 P6 | P 1 | 6.985; 9.045; 10.256 111.87; 104.25; 102 | 549.5 | 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, 2004, 20, x17-x18 |
1100982 | CIF | C52 H58 Co F6 N2 O2 Pd | P 1 | 10.1173; 10.4874; 12.6206 67.012; 73.738; 88.769 | 1177.57 | 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, 2005, 44, 3709-3717 |
1101105 | CIF | C20 H42 N8 Ni O22 | P 1 | 7.152; 8.83; 13.783 82.024; 86.155; 70.9 | 814.3 | 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, 1999, 29, 1009-1013 |
1101134 | CIF | C15 H31.75 Cl0.88 K0.88 N3 O8.38 Pd3 S3 | P 1 | 11.076; 11.045; 24.728 91.19; 94.5; 108.67 | 2853.7 | 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, 1998, 17, 3343-3350 |
1501804 | CIF | C15 H23.5 O5 | P 1 | 8.583; 9.549; 11.107 73.568; 69.697; 67.017 | 774.5 | 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, 2011, 74, 296-299 |
1501831 | CIF | C30 H46 O3 | P 1 | 6.7903; 7.0914; 14.7228 78.885; 81.171; 63.15 | 618.86 | 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, 2011, 74, 1744-1750 |
1501866 | CIF | C24 H22 O2 S | P 1 | 8.351; 10.444; 13.019 105.335; 97.845; 105.307 | 1029.9 | Antczak, Monika I.; Cai, Feng; Ready, Joseph M. Asymmetric synthesis of tertiary benzylic alcohols. Organic letters, 2011, 13, 184-187 |
1501923 | CIF | C128 H112 Na2 O16 P2 Si4 | P 1 | 14.2979; 14.5398; 15.7308 71.49; 87.882; 65.423 | 2802.94 | Hennecke, Ulrich; Müller, Christian H; Fröhlich, Roland Enantioselective haloetherification by asymmetric opening of meso-halonium ions. Organic letters, 2011, 13, 860-863 |
1501963 | CIF | C24 H35 I2 N O5 | P 1 | 8.3429; 8.7613; 9.7629 96.9997; 101.396; 96.5153 | 687.36 | 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, 2011, 13, 1594-1597 |
1501997 | CIF | C25 H28 O9 | P 1 | 13.5779; 13.641; 15.0542 65.339; 65.488; 64.504 | 2191.1 | 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, 2011, 13, 1174-1177 |
1502069 | CIF | C16 H27 N O4 S | P 1 | 7.2192; 11.2843; 17.5962 104.861; 91.043; 106.942 | 1318.66 | Brichacek, Matthew; Villalobos, Mauricio Navarro; Plichta, Alexandra; Njardarson, Jon T. Stereospecific ring expansion of chiral vinyl aziridines. Organic letters, 2011, 13, 1110-1113 |
1502158 | CIF | C24 H24 N2 O3 S2 | P 1 | 9.8593; 11.3699; 11.6474 67.803; 76.579; 89.515 | 1171.33 | 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, 2011, 13, 2472-2475 |
1502210 | CIF | C56 H84 O8 | P 1 | 15.09; 15.095; 15.132 96.611; 116.223; 108.05 | 2808.6 | 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, 2011, 13, 3064-3067 |
1502284 | CIF | C27 H26 Br Cl3 N2 O2 | P 1 | 9.9605; 11.4468; 13.0628 111.413; 100.86; 101.302 | 1303.38 | 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, 2011, 13, 3678-3681 |
1502295 | CIF | C24 H31 N2 O6.5 | P 1 | 7.4783; 11.5713; 13.3812 107.895; 90.072; 93.959 | 1098.97 | 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, 2011, 13, 3888-3891 |
1502401 | CIF | C38 H41 N3 O7 | P 1 | 7.1374; 10.4915; 23.5245 96.57; 91.75; 108.864 | 1651.72 | 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, 2011, 13, 4786-4789 |
1502447 | CIF | C23 H28 N O3 P | P 1 | 5.8722; 9.695; 9.999 109.909; 93.647; 97.854 | 526.49 | 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, 2011, 13, 4862-4865 |
1502505 | CIF | C28 H26 Br2 N4 O3 | P 1 | 7.7053; 13.2135; 13.4615 76.246; 84.746; 79.465 | 1307.17 | Wanner, Benedikt; Mahatthananchai, Jessada; Bode, Jeffrey W. Enantioselective synthesis of dihydropyridinones via NHC-catalyzed aza-Claisen reaction. Organic letters, 2011, 13, 5378-5381 |
1502565 | CIF | C30 H30 Cl N O6 S | P 1 | 8.185; 9.222; 10.247 69.237; 80.106; 84.347 | 711.9 | 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, 2011, 13, 5874-5877 |
1502593 | CIF | C16 H12 N2 O3 S | P 1 | 8.327; 11.225; 16.443 108.255; 96.36; 91.162 | 1448.1 | Wang, Xiao-Na; Shen, Li-Tao; Ye, Song NHC-catalyzed enantioselective [2 + 2] and [2 + 2 + 2] cycloadditions of ketenes with isothiocyanates. Organic letters, 2011, 13, 6382-6385 |
1502718 | CIF | C98.7 H140 O96.95 | P 1 | 15.419; 15.464; 15.612 102.72; 102.012; 104.309 | 3380.1 | 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, 2010, 114, 11489-11495 |
1502819 | CIF | C15 H22 O3 | P 1 | 6.7943; 6.0697; 8.6532 90.358; 104.185; 90.069 | 345.964 | 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, 2010, 73, 388-392 |
1502950 | CIF | C85 H112 Cl3 F12 N5 O21 P2 | P 1 | 10.5785; 12.5308; 20.433 97.683; 97.63; 111.007 | 2457.6 | Su, Yong-Sheng; Chen, Chuan-Feng Novel anthracene-based cylindrical macrotricyclic polyether: powerful host for bispyridinium dications. Organic letters, 2010, 12, 1888-1891 |
1503104 | CIF | C19 H20 O4 | P 1 | 5.3565; 7.6392; 10.099 76.068; 85.27; 86.338 | 399.308 | 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, 2010, 12, 3610-3613 |
1503122 | CIF | C84 H151 N13 O22 | P 1 | 11.2535; 11.6895; 19.1693 86.46; 80.779; 87.428 | 2482.8 | Nagano, Masanobu; Doi, Mitsunobu; Kurihara, Masaaki; Suemune, Hiroshi; Tanaka, Masakazu Stabilized alpha-helix-catalyzed enantioselective epoxidation of alpha,beta-unsaturated ketones. Organic letters, 2010, 12, 3564-3566 |
1503156 | CIF | C43 H44 Cl2 N4 Ni O4 | P 1 | 12.3092; 12.3128; 12.973 90.061; 102.664; 98.557 | 1895.9 | 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, 2010, 12, 4002-4005 |
1503196 | CIF | C26 H24 O8 | P 1 | 6.5748; 8.8652; 10.7627 69.163; 82.406; 82.35 | 578.64 | 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, 2010, 12, 4435-4437 |
1503261 | CIF | C26 H34 Cl4 N O P Pd | P 1 | 8.428; 8.919; 9.803 93.261; 100.551; 95.576 | 718.9 | Dugal-Tessier, Julien; Dake, Gregory R.; Gates, Derek P. Chiral phosphaalkene-oxazoline ligands for the palladium-catalyzed asymmetric allylic alkylation. Organic letters, 2010, 12, 4667-4669 |
1503271 | CIF | C26 H22 Cl4 N3 O2 | P 1 | 10.006; 11.099; 11.923 80.594; 85.493; 89.428 | 1302.3 | 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, 2010, 12, 5442-5445 |
1503313 | CIF | C8 H16 N2 O4 S2 | P 1 | 8.089; 9.221; 9.805 70.49; 68.96; 73.73 | 632.6 | Wang, Yazhou; Hu, Xichao; Du, Haifeng Vicinal-diamine-based chiral chain dienes as ligands for rhodium(I)-catalyzed highly enantioselective conjugated additions. Organic letters, 2010, 12, 5482-5485 |
1503416 | CIF | C77 H81 F24 N9 O12 P4 | P 1 | 13.474; 13.507; 14.013 103.97; 99.34; 118.61 | 2053.8 | Liu, Ming; Li, Shijun; Hu, Menglong; Wang, Feng; Huang, Feihe Selectivity algorithm for the formation of two cryptand/paraquat catenanes. Organic letters, 2010, 12, 760-763 |
1503456 | CIF | C155 H176 N4 O9 | P 1 | 11.6351; 16.2914; 20.4165 75.588; 87.355; 77.305 | 3656.4 | Gibson, Harry W.; Wang, Hong; Niu, Zhenbin; Slebodnick, Carla; Zhakharov, Lev N.; Rheingold, Arnold L. Rotaxanes from Tetralactams Macromolecules, 2012, 45, 1270 |
1503465 | CIF | C16 H18 O5 | P 1 | 7.7085; 9.851; 10.445 80.9; 69.55; 67.39 | 685.8 | Sun, Hao-Fen; Li, Xiao-Ming; Meng, Li; Cui, Chuan-Ming; Gao, Shu-Shan; Li, Chun-Shun; Huang, Cai-Guo; Wang, Bin-Gui Asperolides A-C, Tetranorlabdane Diterpenoids from the Marine Alga-Derived Endophytic Fungus Aspergillus wentii EN-48. Journal of natural products, 2012, 75, 148-152 |
1503483 | CIF | C55 H46 N10 | P 1 | 7.2402; 11.587; 13.95 89.683; 78.116; 74.635 | 1102.8 | 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, 2012, 14, 54-57 |
1503600 | CIF | C23 H23 I N2 O8 | P 1 | 7.9894; 11.0136; 14.6649 90.994; 105.668; 103.389 | 1204.27 | Shan, Mingde; Kishi, Yoshito Concise and highly stereoselective synthesis of the C20-C26 building block of halichondrins and Eribulin Organic Letters, 2012, 14, 660-663 |
1503631 | CIF | C28 H32 Cl2 N2 O8 | P 1 | 5.7819; 9.6587; 13.317 79.109; 82.475; 86.782 | 723.6 | 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, 2012, 16, 286 |
1503636 | CIF | C18 H24 N2 O2 | P 1 | 5.8138; 9.773; 15.314 84.585; 88.44; 79.196 | 850.8 | 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, 2009, 11, 220-227 |
1503677 | CIF | C17 H17 N O6 | P 1 | 8.163; 8.22; 11.652 100.21; 101.26; 91.22 | 753.4 | 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, 2009, 72, 112-116 |
1503685 | CIF | C36 H54 N2 O6 | P 1 | 6.778; 7.8277; 16.835 81.293; 87.547; 72.743 | 843.2 | 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, 2009, 72, 308-311 |
1503692 | CIF | C31 H46 O5 | P 1 | 7.3556; 7.4296; 14.2899 81.762; 82.937; 65.002 | 698.77 | Nuanyai, Thanesuan; Sappapan, Reungrit; Teerawatananond, Thapong; Muangsin, Nongnuj; Pudhom, Khanitha Cytotoxic 3,4-seco-cycloartane triterpenes from Gardenia sootepensis. Journal of natural products, 2009, 72, 1161-1164 |
1503694 | CIF | C30 H48 O4 | P 1 | 6.943; 7.2493; 15.2539 81.411; 80.394; 61.762 | 664.71 | Chen, Wen-Hao; Qi, Huan-Yang; Shi, Yan-Ping 24-Hydroxyoleanane-type triterpenes from the aerial parts and roots of Oxytropis falcata. Journal of natural products, 2009, 72, 1410-1413 |
1503784 | CIF | C56.25 H50.5 Cl1.5 N5 O19.5 | P 1 | 12.936; 13.306; 15.561 98.33; 96.83; 89.96 | 2631 | Legouin, Béatrice; Uriac, Philippe; Tomasi, Sophie; Toupet, Loïc; Bondon, Arnaud; van de Weghe, Pierre Novel chiral molecular tweezer from (+)-usnic acid Organic letters, 2009, 11, 745-748 |
1503793 | CIF Paper | C12 H21 N O | P 1 | 8.5417; 10.2807; 12.64 102.85; 90.091; 91.488 | 1081.78 | 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, 2009, 11, 963-966 |
1503799 | CIF | C54 H80 N6 O16 | P 1 | 13.96; 14.59; 15.59 115.43; 94.94; 96.77 | 2814 | Nagano, Masanobu; Tanaka, Masakazu; Doi, Mitsunobu; Demizu, Yosuke; Kurihara, Masaaki; Suemune, Hiroshi Helical-screw directions of diastereoisomeric cyclic alpha-amino acid oligomers. Organic letters, 2009, 11, 1135-1137 |
1503802 | CIF | C65 H101 N8 O20.5 | P 1 | 9.995; 17.515; 20.382 71.492; 87.501; 89.647 | 3380 | Nagano, Masanobu; Tanaka, Masakazu; Doi, Mitsunobu; Demizu, Yosuke; Kurihara, Masaaki; Suemune, Hiroshi Helical-screw directions of diastereoisomeric cyclic alpha-amino acid oligomers. Organic letters, 2009, 11, 1135-1137 |
1504038 | CIF | C8 H6 Cl I | P 1 | 7.352; 7.365; 16.241 91.31; 91.52; 99.58 | 866.5 | Pawluć, Piotr; Hreczycho, Grzegorz; Szudkowska, Justyna; Kubicki, Maciej; Marciniec, Bogdan New one-pot synthesis of (E)-beta-aryl vinyl halides from styrenes. Organic letters, 2009, 11, 3390-3393 |
1504218 | CIF | C26 H21 O3 | P 1 | 8.4452; 10.6647; 11.566 82.23; 89.149; 77.425 | 1007.26 | 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, 2009, 11, 4752-4755 |
1504219 | CIF | C26 H33 N O3 Si | P 1 | 7.718; 11.898; 14.296 96.932; 103.456; 108.338 | 1184.9 | Tietze, Lutz F.; Tölle, Nina; Kratzert, Daniel; Stalke, Dietmar Efficient formal total synthesis of the erythrina alkaloid (+)-erysotramidine, using a domino process. Organic letters, 2009, 11, 5230-5233 |
1504515 | CIF | C168 H191 N22 Zn2 | P 1 | 13.1202; 16.6253; 17.5706 78.601; 81.694; 89.735 | 3716.5 | 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, 2008, 10, 549-552 |
1504532 | CIF | C27 H41 N O8 S | P 1 | 6.186; 9.556; 13.169 91.968; 99.625; 106.425 | 733.44 | 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, 2008, 10, 841-844 |
1504538 | CIF | C22 H28 N4 | P 1 | 8.854; 10.1088; 11.9207 105.763; 90.439; 95.36 | 1021.72 | Zhao, Baoguo; Du, Haifeng; Shi, Yian Cu(I)-catalyzed cycloguanidination of olefins. Organic letters, 2008, 10, 1087-1090 |
1504587 | CIF | C13 H15 N O3 | P 1 | 5.731; 9.956; 11.765 106.35; 96.43; 100.74 | 623.2 | 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, 2008, 10, 1687-1690 |
1504597 | CIF | C37 H39 F3 N4 O7 S | P 1 | 11.593; 11.938; 14.843 103.82; 93.69; 108.25 | 1872.7 | 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, 2008, 10, 1275-1278 |
1504754 | CIF | C27 H26 N O2 P | P 1 | 9.9856; 10.1967; 11.5731 100.869; 103.617; 90.203 | 1123.29 | 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, 2008, 10, 3195-3198 |
1504759 | CIF | C22 H19 O2 P | P 1 | 9.3998; 9.9414; 11.4269 65.82; 74.446; 71.54 | 912.1 | Cullen, Steven C.; Rovis, Tomislav Catalytic asymmetric stetter reaction onto vinylphosphine oxides and vinylphosphonates. Organic letters, 2008, 10, 3141-3144 |
1504791 | CIF | C20 H28 O2 | P 1 | 6.3335; 7.2872; 20.5729 91.2787; 97.7238; 114.408 | 853.61 | Boukouvalas, John; Wang, Jian-Xin Structure revision and synthesis of a novel labdane diterpenoid from Zingiber ottensii. Organic letters, 2008, 10, 3397-3399 |
1504817 | CIF | C49 H52 N4 O9 | P 1 | 9.1602; 9.9973; 12.4147 79.119; 81.756; 72.924 | 1062.55 | 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, 2008, 10, 3749-3752 |
1504904 | CIF | C18 H24 N4 O8 | P 1 | 7.2898; 9.3886; 15.9051 91.007; 97.177; 111.934 | 999.41 | 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, 2008, 10, 4537-4540 |
1504906 | CIF | C24 H27 N5 O9 | P 1 | 10.8521; 11.1482; 21.2318 82.573; 86.637; 82.618 | 2523.68 | 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, 2008, 10, 4585-4588 |
1505032 | CIF | C30 H48 N2 O3 | P 1 | 6.135; 6.77; 17.17 92.3; 97.87; 99.35 | 695.6 | 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, 2007, 50, 5311-5323 |
1505221 | CIF | C50 H88 Cl6 O15 | P 1 | 10.0874; 12.5229; 13.6632 65.648; 88.15; 86.102 | 1568.77 | Wagenaar, Melissa M.; Williamson, R. Thomas; Ho, Douglas M.; Carter, Guy T. Structure and absolute stereochemistry of 21-hydroxyoligomycin A. Journal of natural products, 2007, 70, 367-371 |
1505341 | CIF | C9 H18 N2 O3 | P 1 | 12.5522; 5.516; 15.9248 89.816; 87.074; 89.234 | 1101.1 | 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, 2007, 9, 1347-1350 |
1505512 | CIF | C60 H60 N2 O9 | P 1 | 5.7753; 14.7522; 16.0657 116.528; 91.539; 94.751 | 1217.32 | 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, 2007, 9, 3457-3460 |
1505617 | CIF | C16 H14 Br2 S2 | P 1 | 6.8118; 9.889; 12.2513 91.288; 105.065; 103.457 | 772 | 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, 2007, 9, 4881-4884 |
1505674 | CIF | C17 H21 N O6 | P 1 | 4.95; 5.1931; 33.2 91.997; 92.826; 90.042 | 851.9 | Gerhardt, Warren W.; Noga, David E.; Hardcastle, Kenneth I.; García, Andrés J; Collard, David M.; Weck, Marcus Functional lactide monomers: methodology and polymerization. Biomacromolecules, 2006, 7, 1735-1742 |
1505780 | CIF | C22 H28 Br2 N4 O2 Zn | P 1 | 9.2428; 11.5764; 11.4434 89.98; 102.657; 89.997 | 1194.67 | Chen, Hsuan-Ying; Tang, Hui-Yi; Lin, Chu-Chieh Ring-Opening Polymerization of Lactides Initiated by Zinc Alkoxides Derived from NNO-Tridentate Ligands Macromolecules, 2006, 39, 3745-3752 |
1505803 | CIF | C36 H38 N2 O10 | P 1 | 6.564; 15.654; 16.701 94.618; 92.568; 100.754 | 1677.32 | 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, 2006, 69, 1198-1202 |
1505916 | CIF | C25 H24 Br N O3 | P 1 | 6.1276; 12.1417; 15.6434 109.99; 95.395; 95.643 | 1078.26 | Smith, 3rd, Amos B; Davulcu, Akin H.; Kürti, Laszló Indole diterpenoid synthetic studies. Construction of the heptacyclic core of (-)-nodulisporic acid D. Organic letters, 2006, 8, 1669-1672 |
1505955 | CIF | C54 H67 N2 O10 P S2 | P 1 | 8.793; 10.789; 16.09 109.16; 90.96; 112.66 | 1312.5 | 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, 2006, 8, 2455-2458 |
1506098 | CIF | C44 H72 O16 | P 1 | 8.9947; 10.8105; 13.9124 81.632; 73.88; 67.096 | 1196.1 | 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, 2006, 8, 3315-3318 |
1506107 | CIF | C19 H24 N2 O2 | P 1 | 9.6027; 10.0645; 11.093 110.209; 109.26; 101.701 | 887 | 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, 2006, 8, 3351-3354 |
1506323 | CIF | C56 H78 Cl4 Cu2 N18 O21 | P 1 | 12.0986; 12.7138; 13.3209 77.309; 81.44; 74.732 | 1919.4 | 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, 2006, 8, 6099-6102 |
1506352 | CIF | C28 H38 N O6 P | P 1 | 6.413; 13.141; 17.092 82.02; 86.3; 76.29 | 1385.1 | 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, 2005, 48, 5373-5377 |
1507002 | CIF | C16 H28 N2 O5 S | P 1 | 6.1035; 8.9701; 9.7458 117.015; 93.643; 94.915 | 470.44 | 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, 2004, 6, 3621-3624 |
1507079 | CIF | C124 H104 B2 F48 Ir2 N2 O4 P2 | P 1 | 12.8996; 12.9357; 22.1831 105.044; 92.7318; 117.366 | 3113.94 | Smidt, Sebastian P.; Menges, Frederik; Pfaltz, Andreas SimplePHOX, a readily available chiral ligand system for iridium-catalyzed asymmetric hydrogenation. Organic letters, 2004, 6, 2023-2026 |
1507080 | CIF | C123 H101 B2 Cl3 F48 Ir2 N2 O4 P2 | P 1 | 12.7425; 12.992; 23.0228 87.9035; 74.6505; 61.9161 | 3225.32 | Smidt, Sebastian P.; Menges, Frederik; Pfaltz, Andreas SimplePHOX, a readily available chiral ligand system for iridium-catalyzed asymmetric hydrogenation. Organic letters, 2004, 6, 2023-2026 |
1507084 | CIF | C17 H16 N2 O | P 1 | 5.7296; 11.8879; 5.0674 100.472; 92.263; 83.228 | 336.98 | 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, 2004, 6, 2241-2244 |
1507221 | CIF | C21 H35 N7 O18 P2 | P 1 | 8.592; 8.845; 11.192 109.64; 90.56; 103.92 | 773.7 | 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, 2003, 107, 9109 |
1507260 | CIF | C25 H34 O3 | P 1 | 6.2563; 6.9299; 13.824 80.507; 77.19; 68.994 | 543.2 | Demeke, Damtew; Forsyth, Craig J. Total synthesis and stereochemistry of (-)-cacospongionolide F. Organic letters, 2003, 5, 991-994 |
1507322 | CIF | C18 H28 O6 | P 1 | 8.2496; 10.1013; 11.6656 82.558; 82.658; 82.064 | 948.7 | 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, 2003, 5, 2149-2152 |
1507387 | CIF | C28 H26 N2 O3 S | P 1 | 8.058; 10.51; 15.705 72.19; 76.159; 73.244 | 1195.8 | 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, 2003, 5, 4155-4157 |
1507393 | CIF | C21 H24 O8 S2 | P 1 | 5.408; 8.242; 13.494 96.4; 97.35; 104.99 | 569.6 | 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, 2003, 5, 4361-4364 |
1507487 | CIF | C44 H36 Cl10 Fe2 N4 O S6 | P 1 | 13.844; 13.846; 18.7 71.71; 71.68; 60.87 | 2916 | Kozaki, M.; Yonezawa, Y.; Okada, K. Cyclopentadithiophene (CPDT) dimer dication: bipolaron model for quaterthiophenes. Organic letters, 2002, 4, 4535-4538 |
1507624 | CIF | C30 H24 Br N O3 S | P 1 | 10.4778; 10.5926; 12.6565 66.666; 75.97; 73.169 | 1221.46 | 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, 2012, 14, 2154-2157 |
1507712 | CIF | C16 H16 N2 O S2 | P 1 | 8.3985; 11.9291; 15.318 101.135; 94.64; 90.106 | 1500.6 | Schönherr, Heike; Leighton, James L. Direct and highly enantioselective iso-Pictet-Spengler reactions with α-ketoamides: access to underexplored indole core structures. Organic letters, 2012, 14, 2610-2613 |
1507748 | CIF | C27 H28 Br N O6 | P 1 | 5.036; 10.9704; 11.4714 89.596; 84.698; 86.513 | 629.88 | 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, 2012, 14, 2894-2897 |
1507994 | CIF | C26 H29 B2 Br N2 O4 | P 1 | 9.058; 9.824; 14.734 98.499; 96.322; 92.204 | 1286.8 | Lee, Jack Chang Hung; McDonald, Robert; Hall, Dennis G. Enantioselective preparation and chemoselective cross-coupling of 1,1-diboron compounds. Nature chemistry, 2011, 3, 894-899 |
1508337 | CIF | C24 H34 Br Cl N4 O7 | P 1 | 5.6722; 8.1511; 14.9077 102.962; 94.38; 93.876 | 667.18 | Kopina, Brett J.; Lauhon, Charles T. Efficient preparation of 2,4-diaminopyrimidine nucleosides: total synthesis of lysidine and agmatidine. Organic letters, 2012, 14, 4118-4121 |
1508358 | CIF | C24 H37 N O4 | P 1 | 5.6229; 8.7918; 12.5901 81.487; 82.616; 76.535 | 595.75 | 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, 2012, 14, 4278-4281 |
1508399 | CIF | C56 H102.5 O50.75 | P 1 | 15.4039; 15.2813; 17.8904 99.662; 113.423; 102.481 | 3618.4 | 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, 2012, 2, 1441-1454 |
1508615 | CIF | C62 H64 Ag F3 N4 O8 S | P 1 | 10.1935; 10.3796; 13.4375 79.073; 84; 81.856 | 1377.5 | 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, 2012, 14, 4576-4579 |
1508696 | CIF | C20 H31 Br N2 O5 | P 1 | 8.0748; 15.1323; 29.19 98.815; 92.189; 105.25 | 3388.9 | 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, 2012, 14, 5314-5317 |
1508808 | CIF | C15 H29 N O3 Si | P 1 | 6.8088; 8.1381; 32.921 90; 90; 90 | 1824.2 | 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, 2012, 14, 6222-6225 |
1508821 | CIF | C26 H20 | P 1 | 6.95; 7.4; 17.571 92.119; 96.424; 90.191 | 897.4 | 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, 2013, 117, 566-578 |
1508882 | CIF | C24 H19 N O5 S | P 1 | 5.737; 8.686; 10.931 83.072; 79.957; 75.074 | 516.6 | 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, 2013, 15, 542-545 |
1508915 | CIF | C38 H44 N2 O8 S | P 1 | 10.54; 13.2962; 13.7619 71.577; 89.697; 69.957 | 1707.4 | Rajapaksa, Naomi S.; McGowan, Meredeth A.; Rienzo, Matthew; Jacobsen, Eric N. Enantioselective total synthesis of (+)-reserpine. Organic letters, 2013, 15, 706-709 |
1508932 | CIF | C22 H14 Cl4 N2 O5 | P 1 | 7.649; 11.8911; 12.6157 105.779; 98.658; 92.067 | 1088.06 | 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, 2013, 15, 988-991 |
1510905 | CIF | B2 Cd2 O5 | P 1 | 6.36; 9.95; 3.45 90.83; 91.96; 105.47 | 210.227 | Belov, N.V.; Sokolova, E.V.; Simonov, M.A. Crystal structure of cadmium pyroborate Cd2 B2 O5 Doklady Akademii Nauk SSSR, 1979, 247, 603-606 |
1511275 | CIF | B O3 Sm | P 1 | 6.493; 6.499; 6.242 107.79; 107.42; 93.33 | 236.037 | Kuznetsova, V.G.; Dzhurinskii, B.F.; Palkina, K.K.; Butman, L.A. The crystal structure of Sm B O3 Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)), 1976, 2, 286-289 |
1511764 | CIF | C20 H30 Br2 N8 O13 Pd | P 1 | 6.962; 10.242; 10.547 85.1; 73.24; 89.17 | 717.4 | 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, 1993, 204, 213-220 |
1511765 | CIF | C20 H34 Cl2 N8 O15 Pd | P 1 | 15.681; 7.406; 6.846 92.99; 105.25; 85.48 | 764.3 | 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, 1993, 204, 213-220 |
1511767 | CIF | C23 H27 Br O4 | P 1 | 6.669; 9.235; 10.462 67.05; 73.43; 69.22 | 546.6 | 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, 1994, 57, 873-881 |
1511789 | CIF | C22 H42 B2 F4 Li2 O14 | P 1 | 8.554; 8.841; 12.929 93.573; 108.72; 114.576 | 820.1 | 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, 2013, 117, 5521 |
1511851 | CIF | C36.25 H54 F3 N8 O6.25 | P 1 | 15.0672; 15.6539; 17.4818 97.737; 99.263; 97.544 | 3982.82 | Chouhan, Gagan; James, Keith Efficient construction of proline-containing β-turn mimetic cyclic tetrapeptides via CuAAC macrocyclization. Organic letters, 2013, 15, 1206-1209 |
1511909 | CIF | C20 H19 Br N4 O3 | P 1 | 9.2928; 10.4817; 11.6022 75.347; 66.757; 89.136 | 1000.04 | 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, 2013, 15, 1846-1849 |
1512323 | CIF | C22 H25 N2 O10.5 | P 1 | 6.3054; 9.0002; 20.798 97.215; 92.994; 98.644 | 1154.59 | Granda, Jarosław M.; Jurczak, Janusz Sweet Anion Receptors: Recognition of Chiral Carboxylate Anions byd-Glucuronic-Acid-Decorated Diindolylmethane Organic Letters, 2013, 15, 4730 |
1512329 | CIF | C18 H24 Br N3 O4 | P 1 | 5.72; 11.095; 15.48 83.6; 88.96; 80.16 | 962 | 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, 2013, 15, 4766-4769 |
1512811 | CIF | C34 H28 N4 O10 Zn | P 1 | 5.0612; 10.1638; 16.0051 83.651; 88.514; 87.149 | 817.08 | Devendra Singh; Jubaraj B. Baruah Hydroxy-carboxylates of manganese, zinc and cadmium Inorganica Chimica Acta, 2013, 394, 703-709 |
1512812 | CIF | C48 H39 Mn2 N4 O28 | P 1 | 5.5897; 16.5961; 16.6125 73.622; 85.665; 82.482 | 1464.64 | Devendra Singh; Jubaraj B. Baruah Hydroxy-carboxylates of manganese, zinc and cadmium Inorganica Chimica Acta, 2013, 394, 703-709 |
1512989 | CIF | C26 H36 N6 O15 S2 Zn2 | P 1 | 7.5389; 10.1054; 13.185 69.441; 81.181; 69.029 | 877.8 | 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, 2011, 365, 363-370 |
1513025 | CIF | C54 H92 Co8 N12 O45 | P 1 | 13.9081; 13.9147; 14.0033 113.529; 111.7; 102.769 | 2081.3 | 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, 2013, 397, 48-59 |
1513062 | CIF | C14 H15 Cl2 N3 O2 | P 1 | 4.8102; 5.795; 13.462 84.048; 87.302; 83.256 | 370.4 | 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, 2013, 76, 415 |
1513360 | CIF | C38 H48 N4 O9 | P 1 | 10.1848; 10.362; 10.3848 71.742; 67.38; 60.647 | 871.11 | 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, 2014, 77, 327-338 |
1513374 | CIF | C23 H24 O8 | P 1 | 10.4726; 11.2226; 11.4289 60.65; 89.832; 67.745 | 1055.4 | 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, 2014, 77, 70-78 |
1513446 | CIF | C74 H78 F8 I2 N2 | P 1 | 14.078; 15.968; 16.71 107.796; 101.993; 90.015 | 3490.3 | 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, 2014, 16, 1136-1139 |
1513483 | CIF | C28 H28 N2 O2 | P 1 | 9.3592; 9.858; 13.1796 86.612; 87.077; 84.894 | 1207.77 | 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, 2014, 16, 776-779 |
1513520 | CIF | C15 H19 N3 O2 | P 1 | 8.665; 8.848; 10.375 74.678; 79.658; 83.356 | 752.7 | 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, 2014, 16, 42-45 |
1513746 | CIF | C49 H37 F6 N3 O2 S2 | P 1 | 11.2226; 14.6368; 14.7457 82.159; 68.326; 88.858 | 2228.66 | 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, 2014, 13, 199-204 |
1513747 | CIF | C49 H37 F6 N3 O2 S2 | P 1 | 11.203; 14.6411; 14.7813 82.469; 68.116; 89.224 | 2228.7 | 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, 2014, 13, 199-204 |
1513752 | CIF | C24 H27 N O6 | P 1 | 4.9526; 10.2028; 10.7011 92.352; 94.615; 96.777 | 534.51 | 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, 2014, 13, 224-230 |
1513799 | CIF | C11 H13 N5 O5 | P 1 | 4.9116; 8.8528; 13.96 105.332; 93.529; 91.847 | 583.54 | 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, 2014, 5, 3108 |
1513829 | CIF | C23 H40 I N O5 Si2 | P 1 | 9.2285; 12.5843; 12.7057 99.428; 109.693; 94.741 | 1355.32 | Coste, Alexis; Bayle, Alexandre; Marrot, Jérome; Evano, Gwilherm A Convergent Synthesis of the Fully Elaborated Macrocyclic Core of TMC-95A. Organic letters, 2014, 16, 1306-1309 |
1514212 | CIF | C18 H25 N O6 | P 1 | 6.5131; 7.9315; 9.954 90.89; 94.28; 112.44 | 473.4 | 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, 2014, 16, 1936-1939 |
1514515 | CIF | C25 H26 Cl2 F25 N3 O8 P4 Rh2 | P 1 | 10.1595; 10.386; 12.0283 73.962; 69.049; 71.477 | 1104.74 | 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), 2013, 4, 2880 |
1514536 | CIF | C38 H62 O9 | P 1 | 8.7254; 9.5176; 12.415 89.65; 80.46; 70.65 | 958 | Yu, Jun; Sun, Jiansong; Niu, Yiming; Li, Rongyao; Liao, Jinxi; Zhang, Fuyi; Yu, Biao Synthetic access toward the diverse ginsenosides Chemical Science, 2013, 4, 3899 |
1514550 | CIF | C27 H32 O11 | P 1 | 9.4188; 9.7589; 15.1515 96.812; 97.849; 109.187 | 1282.95 | 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, 2013, 4, 3979 |
1514581 | CIF | C28 H27 N3 O3 | P 1 | 9.552; 10.569; 13.458 71.185; 76.497; 77.422 | 1235.4 | 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, 2013, 4, 1308 |
1514677 | CIF | C40 H54 I N3 O Pd | P 1 | 11.3782; 12.8716; 13.5328 103.493; 91.2746; 90.1766 | 1926.7 | 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, 2013, 4, 1995 |
1514715 | CIF | C16 H12 N O2 S | P 1 | 6.0479; 8.1021; 14.5564 81.543; 83.748; 72.375 | 670.83 | 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, 2013, 4, 2163 |
1514777 | CIF | C32.33 H36.66 Cl0.66 N4 O10 S Si | P 1 | 13.7346; 16.0038; 17.3585 100.01; 92.214; 108.59 | 3543.2 | Coste, Alexis; Kim, Justin; Adams, Timothy C.; Movassaghi, Mohammad Concise Total Synthesis of (+)-Bionectins A and C. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 3191-3197 |
1514822 | CIF | C19 H37 Cl N8 Ni O8 Zn | P 1 | 8.5274; 12.4106; 13.0776 98.754; 96.004; 90.074 | 1360.17 | Uyeda, Christopher; Peters, Jonas C. Access to formally Ni(i) states in a heterobimetallic NiZn system Chemical Science, 2013, 4, 157 |
1514975 | CIF | C71 H93 Ag3 Cl4 F12 N18 O8 P2 | P 1 | 12.6553; 13.0092; 15.1663 104.239; 112.9; 99.765 | 2128.75 | 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, 2012, 3, 359 |
1515178 | CIF | C23 H22 O5 | P 1 | 7.7512; 8.1381; 8.4256 69.558; 79.669; 74.031 | 476.75 | 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, 2012, 3, 1879 |
1515268 | CIF | C18 H21 N O6 | P 1 | 11.3125; 12.0218; 13.7304 102.179; 107.108; 93.227 | 1730.44 | 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, 2012, 3, 121 |
1515275 | CIF | C14 H21 N9 O6 | P 1 | 15.8942; 16.2322; 17.6688 89.748; 72.741; 63.537 | 3853.3 | 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, 2012, 3, 249 |
1515278 | CIF | C56 H118 N13 O47 S5 | P 1 | 6.6138; 16.3922; 23.9598 101.113; 92.328; 95.176 | 2534 | 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, 2012, 3, 249 |
1515320 | CIF | C35 H38 N4 Ni O5 | P 1 | 10.232; 12.112; 12.792 76.697; 79.053; 81.737 | 1506.4 | 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, 2012, 11, 898-907 |
1515345 | CIF | C142 H226 N10 O16 | P 1 | 6.1385; 14.6387; 37.9634 83.436; 86; 80.353 | 3336.63 | 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, 2012, 8, 7840 |
1515556 | CIF | C96 H102 Cl N5 O20 | P 1 | 11.009; 17.213; 25.06 73.3; 82.6; 79.77 | 4461 | Leontiev, Alexandre V.; Serpell, Christopher J.; White, Nicholas G.; Beer, Paul D. Cation-induced molecular motion of spring-like [2]catenanes Chemical Science, 2011, 2, 922 |
1515785 | CIF | C104 H151 N11 O10 | P 1 | 8.932; 12.45; 22.583 93.679; 100.549; 98.64 | 2429.96 | Gale, Philip A.; Hiscock, Jennifer R.; Jie, Chen Zhu; Hursthouse, Michael B.; Light, Mark E. Acyclic indole and carbazole-based sulfate receptors Chemical Science, 2010, 1, 215 |
1515870 | CIF | C77 H56 B F24 Ir N O P | P 1 | 12.8218; 14.836; 18.8757 96.898; 99.557; 95.874 | 3487.6 | 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, 2010, 1, 72 |
1515871 | CIF | C23 H19 N O | P 1 | 7.6503; 12.8616; 18.8654 106.228; 98.815; 101.265 | 1704.86 | 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, 2010, 1, 72 |
1515999 | CIF | C61 H48 Cl Fe O3 P2 Rh | P 1 | 9.356; 10.965; 12.863 75.982; 74.937; 78.025 | 1221.5 | Tanaka, Kenichi; Kinbara, Kazushi Toward autonomously operating molecular machines driven by transition-metal catalyst. Molecular bioSystems, 2008, 4, 512-514 |
1516022 | CIF | C36.5 H68 O15.5 | P 1 | 7.1558; 12.8203; 21.033 85.657; 88.636; 77.863 | 1880.95 | 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, 2014, 77, 1201 |
1516269 | CIF | C73 H48 B F15 O7 U | P 1 | 15.1204; 16.1764; 16.4479 112.966; 96.391; 115.286 | 3157 | 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, 2014, 5, 3204 |
1516334 | CIF | C24 H21 Br2 N | P 1 | 8.187; 9.207; 27.256 90.044; 89.948; 106.384 | 1971.1 | 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, 2014, 13, 1093-1105 |
1516351 | CIF | C28 H60 O2 P2 Pd S2 | P 1 | 8.538; 10.605; 11.064 67.828; 81.864; 85.056 | 917.8 | 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, 2009, 113, 14730-14740 |
1516526 | CIF | C28 H30 N2 O3 | P 1 | 6.63; 8.27; 22.07 89.6; 87.7; 80 | 1191 | 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, 2014, 16, 3348-3351 |
1516734 | CIF | C108 H170 N2 O100 | P 1 | 18.071; 15.375; 15.554 104.07; 113.02; 98.53 | 3711.9 | 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, 2006, 110, 26375-26387 |
1516735 | CIF | C108 H170 N2 O97 | P 1 | 18.025; 15.364; 15.541 103.83; 113.06; 98.61 | 3699.8 | 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, 2006, 110, 26375-26387 |
1516736 | CIF | C108 H170 N2 O99 | P 1 | 17.97; 15.393; 15.514 103.18; 113.22; 98.91 | 3693.4 | 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, 2006, 110, 26375-26387 |
1516737 | CIF | C108 H170 N2 O102 | P 1 | 17.915; 15.405; 15.542 103.04; 113.35; 99.15 | 3685.5 | 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, 2006, 110, 26375-26387 |
1516738 | CIF | C108 H170 N2 O100 | P 1 | 17.896; 15.389; 15.519 103.01; 113.43; 99.07 | 3672 | 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, 2006, 110, 26375-26387 |
1516739 | CIF | C108 H154 N2 O101 | P 1 | 17.78; 15.31; 15.35 102.76; 113.31; 99.24 | 3596 | 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, 2006, 110, 26375-26387 |
1516764 | CIF | C13 H17 N O S | P 1 | 6.208; 7.7318; 14 100.602; 91.28; 104.16 | 638.8 | Guntreddi, Tirumaleswararao; Vanjari, Rajeshwer; Singh, Krishna Nand Decarboxylative Thioamidation of Arylacetic and Cinnamic Acids: A New Approach to Thioamides. Organic letters, 2014, 16, 3624 |
1516961 | CIF | C38 H32 N2 O2 Pd | P 1 | 6.683; 15.639; 15.685 88.127; 84.123; 79.058 | 1600.9 | Takashi Tsuno; Haruka Iwabe; Henri Brunner Synthesis and structural characterization of isomeric palladium(II) complexes with chiral N,O-bidentate ligands Inorganica Chimica Acta, 2013, 400, 262-266 |
1516968 | CIF | C23 H19 Br O4 | P 1 | 8.0129; 8.8764; 14.284 75.661; 88.56; 73.636 | 943.3 | Li, Lijun; Su, Cunxiang; Liu, Xiaoqin; Tian, Hua; Shi, Yian Catalytic Asymmetric Intermolecular Bromoesterification of Unfunctionalized Olefins. Organic letters, 2014, 16, 3728 |
1517178 | CIF | C22 H19 Cl N2 O2 S | P 1 | 10.0479; 10.4624; 10.6624 93.078; 90.52; 118.662 | 981.34 | 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, 2014, 16, 3962-3965 |
1517195 | CIF | C16 H12 Br N O | P 1 | 6.3154; 8.1371; 14.3362 85.222; 78.52; 70.043 | 678.53 | 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., 2014, 5, 4216 |
1517210 | CIF | C56 H66 F6 N4 O6 Zn2 | P 1 | 10.3348; 10.8803; 13.2532 113.176; 96.805; 91.083 | 1356.84 | 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, 2014, 5, 4004 |
1517233 | CIF | C19 H21 N O3 S | P 1 | 7.176; 10.859; 12.059 100.648; 106.125; 95.565 | 876.2 | 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, 2014, 16, 4118-4121 |
1517266 | CIF | C65 H87 N O14 | P 1 | 11.0003; 11.3149; 11.9224 88.459; 75.604; 82.956 | 1426.49 | 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, 2014, 16, 4216-4219 |
1517364 | CIF | C103 H57 B F46 Mn N O P4 | P 1 | 13.826; 14.0301; 14.8023 108.714; 109.969; 96.491 | 2474.82 | 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., 2014, 5, 4729 |
1517403 | CIF | C35 H35 O17.5 S1.5 | P 1 | 9.18695; 9.48126; 21.1713 82.38; 83.5029; 79.8305 | 1791.47 | 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, 2014, 77, 2021-2028 |
1517804 | CIF | C30 H48 O7 | P 1 | 12.9465; 14.7156; 15.0171 89.616; 73.336; 78.252 | 2679.35 | 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, 2014, 77, 2248-2254 |
1517814 | CIF | C36 H40 Br2 O6 | P 1 | 7.58; 12.228; 20.041 97.8; 97; 107.58 | 1728.1 | 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, 2014, 16, 5216-5219 |
1517959 | CIF | C11 H9 Cl N4 O2 | P 1 | 7.0512; 8.2526; 10.6656 73.101; 82.494; 86.39 | 588.55 | 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, 2014, 16, 5339-5341 |
1518071 | CIF | C17 H26 N2 O9 | P 1 | 5.0198; 9.5967; 10.9206 84.776; 82.397; 83.744 | 516.78 | 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, 2014, 16, 5512-5515 |
1518131 | CIF | C18 H29 N O3 | P 1 | 5.8126; 12.6069; 13.068 102.911; 92.604; 90.251 | 932.3 | 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, 2014, 16, 5560-5563 |
1518344 | CIF | C24 H26 N2 O5 | P 1 | 6.25441; 12.592; 13.61853 100.755; 92.7028; 95.0674 | 1047.35 | Cabanillas, Alejandro; Davies, Christopher D.; Male, Louise; Simpkins, Nigel S. Highly enantioselective access to diketopiperazines via cinchona alkaloid catalyzed Michael additions Chem. Sci., 2015, 6, 1350 |
1518416 | CIF | C34 H35 N O14 | P 1 | 7.4957; 12.0298; 17.8347 87.387; 87.555; 74.708 | 1548.85 | 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, 2015, 78, 524-529 |
1518484 | CIF | C54 H75 N8 O16 S | P 1 | 9.1948; 12.5947; 13.668 79.379; 77.83; 78.547 | 1499.6 | 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, 2015, 17, 230-233 |
1518546 | CIF | C9 H5 F3 Mo O3 | P 1 | 6.453; 6.544; 6.7851 107.752; 97.132; 107.192 | 253.356 | 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., 2015, 5, 2282 |
1518618 | CIF | C20 H17 Br N2 O | P 1 | 9.8359; 10.161; 10.307 76.557; 73.136; 64.754 | 884.6 | Fu, Niankai; Zhang, Long; Luo, Sanzhong Chiral Primary Amine Catalyzed Asymmetric Michael Addition of Malononitrile to α-Substituted Vinyl Ketone. Organic letters, 2015, 17, 382-385 |
1518777 | CIF | C28 H36 F36 Mg2 N8 O26 S12 | P 1 | 11.4359; 12.0538; 13.8956 69.152; 82.96; 81.651 | 1765.86 | 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, 2015, 119, 5878 |
1518820 | CIF | C23 H17 N O | P 1 | 9.9575; 10.7208; 16.4862 91.531; 105.749; 104.208 | 1633.82 | 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, 2015, 17, 1481-1484 |
1519161 | CIF | C24 H12 N6 | P 1 | 11.276; 12.833; 12.915 99.7; 112.31; 115.53 | 1431.4 | Janczak, Jan; Kubiak, Ryszard Tris(2-cyanophenyl)-1,3,5-triazine: a By-product of Metallophthalocyanine Synthesis Acta Chemica Scandinavica, 1999, 53, 602-610 |
1519350 | CIF | C18 H51 Na3 O15 Si3 | P 1 | 9.1615; 10.1143; 18.1371 88.586; 80.238; 70.995 | 1565.16 | Taylor, Peter. G.; Gelbrich, Thomas; Hursthouse, Michael B. C36H102Na6O30Si6 Crystal Structure Report Archive, 2001, 826 |
1519496 | CIF | C22 H20 Br N | P 1 | 6.134; 7.123; 10.777 102.328; 106.299; 90.659 | 440.2 | Zhang, Zhenhua; Du, Haifeng Cis-selective and highly enantioselective hydrogenation of 2,3,4-trisubstituted quinolines. Organic letters, 2015, 17, 2816-2819 |
1519904 | CIF | C12 H25 N O5 | P 1 | 6.1782; 7.5786; 8.0969 100.526; 91.585; 107.06 | 355 | Callear, Samantha K.; Hursthouse, Michael B. 1,1,3,3-Tetramethylbutylammonium malate Crystal Structure Report Archive, 2008, 560 |
1519956 | CIF | C13 H28 N2 O14 | P 1 | 7.4774; 7.7071; 16.2943 88.321; 86.355; 89.778 | 936.72 | Callear, Samantha K.; Hursthouse, Michael B.; Threlfall, Terence L. 1-Methylpiperazinium di(L-tartrate) dihydrate Crystal Structure Report Archive, 2008, 583 |
1519975 | CIF | C5 H11 N O6 | P 1 | 5.158; 5.3261; 7.5218 78.735; 83.33; 79.077 | 198.31 | Callear, Samantha K.; Hursthouse, Michael B.; Threlfall, Terence L. Methylammonium L-tartrate Crystal Structure Report Archive, 2008, 579 |
1520139 | CIF | C34 H38 N4 O2 | P 1 | 9.631; 10.027; 15.551 86.83; 87.67; 78.27 | 1467.5 | 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), 2015, 44, 12700-12710 |
1520481 | CIF | C13 H0 F3 N | P 1 | 6.3923; 7.4769; 21.635 90; 90.03; 90 | 1034 | Tizzard, G.; Threlfall, T.; Ling, S.; Coles, S. (E)-2,4-difluoro-N-(4-fluorobenzylidene)aniline Crystal Structure Report Archive, 2010, 1426 |
1520534 | CIF | C20 H20 N4 O4 | P 1 | 7.9466; 14.9541; 16.2556 78.9198; 79.5663; 82.7612 | 1856 | 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), 2015, 6, 4479-4483 |
1521026 | CIF | O11 Sr3 Te4 | P 1 | 7.531; 9.24; 9.546 98.07; 109.55; 102.19 | 595.586 | Dytyatev, O.A.; Dolgikh, V.A. On the crystal structure of a new binary oxide Sr3 Te4 O11 Materials Research Bulletin, 1999, 34, 733-740 |
1521822 | CIF | H4.9 Mo O8.45 U | P 1 | 14.69; 7.535; 6.372 90.07; 85.9; 97.1 | 698.091 | 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, 2000, 373, 202-205 |
1522058 | CIF | Al H4 O6 P | P 1 | 9.026; 9.338; 9.508 95.1; 104.1; 96.6 | 766.381 | 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, 2000, 104, 5697-5705 |
1523329 | CIF | Co Na4 O3 | P 1 | 8.144; 6.22; 5.758 117.54; 89.99; 111.24 | 236.065 | Burow, W.; Hoppe, R. Zur Kenntnis der Oxocobaltate(II) Na4 (Co O3), ein Nesocobaltat(II) Zeitschrift fuer Anorganische und Allgemeine Chemie, 1979, 459, 59-71 |
1524300 | CIF | Fe O6 Si4 | P 1 | 5.431; 5.431; 17.73999 124.14; 95.86; 120 | 317.125 | Eggleton, R.A.; Bailey, S.W. The crystal structure of stilpnomelane. Part I. The subcell Clays and Clay Minerals (-28,1980), 1966, 13, 49-63 |
1525883 | CIF | Fe6.314 H4 K1.875 Na O31 Si8 Ti2 | P 1 | 5.359; 11.614; 11.861 113.16; 103.04; 94.56 | 649.457 | 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, 2001, 44, 508-516 |
1525950 | CIF | Ga2 O11 Te4 | P 1 | 5.125; 6.559; 8.173 75.06; 89.25; 69.62 | 247.938 | Dutreilh, M.; Thomas, P.; Frit, B.; Champarnaud-Mesjard, J.C. Crystal structure of a new gallium tellurite: Ga2 Te4 O11 Solid State Sciences, 2001, 3, 423-431 |
1526013 | CIF | B5 Ca Cl H2 O10 Sr | P 1 | 6.5732; 6.4445; 6.3693 60.995; 61.257; 77.191 | 206.872 | Ferro, O.; Pekov, I.V.; Pushcharovskii, D.Yu.; Lovskaya, E.V.; Teat, S.; Vinogradova, S.A. Crystal structure of strontian hilgardite Kristallografiya, 2000, 45, 452-457 |
1526063 | CIF | D18 N4 O12 Se3 | P 1 | 7.65; 10.336; 10.509 114.34; 93.29; 107.53 | 705.998 | 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, 2001, 100, 53-65 |
1526340 | CIF | Cu O3 V | P 1 | 4.9646; 5.4023; 4.9154 90.32; 119.31; 63.93 | 99.496 | 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, 1972, 5, 446-451 |
1526580 | CIF | Li N2 Na5 | P 1 | 6.57; 4.056; 3.7288 89.48; 90.53; 88.84 | 99.336 | 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, 2000, 2, 449-456 |
1527052 | CIF | O5.96 Pb2.667 V1.333 | P 1 | 6.075; 4.384; 6.124 84.4; 93.25; 94.55 | 161.612 | Zyryanov, V.V.; Lapina, O.B. Mechanochemical synthesis and structure of new phases in the Pb - V - O system Neorganicheskie Materialy, 2001, 37, 331-337 |
1528084 | CIF | Gd2 Ge2 O7 | P 1 | 18.5; 6.8; 6.858 87.88; 91.52; 94.55 | 859.188 | Smolin, Yu.I.; Butikova, I.K.; Shepelev, Yu.F. Determination of the crystal structure of Gd2 Ge2 O7 Kristallografiya, 1971, 16, 911-917 |
1528470 | CIF | C13 H52 N6.5 O129.125 P4 W30 Zr | P 1 | 15.325; 21.014; 22.173 83.639; 89.636; 84.175 | 7059.89 | Fang Xikui; Hill, C.L. Multiple reversible protonation of polyoxoaniom surfaces: direct observation of dynamic structural effects from proton transfer Angewandte Chemie (Edition international), 2007, 46, 3877-3880 |
1528767 | CIF | N2 O2 Si2 Sr1.02 | P 1 | 7.08021; 7.23058; 7.25535 88.7669; 84.7333; 75.9047 | 358.727 | Oeckler, O.; Stadler, F.; Schnick, W.; Rosenthal, T. Real structure of Sr Si2 O2 N2 Solid State Sciences, 2007, 9, 205-212 |
1528811 | CIF | Al Ca16 Cl4 H Mg2 O32 Si7 | P 1 | 15.1; 15.11; 15.092 90.06; 90.01; 89.93 | 3443.4 | Rastsvetaeva, R.K.; Zadov, A.E.; Chukanov, N.V. Crystal structure of low-symmetry rondorfite Kristallografiya, 2008, 53, 226-232 |
1529313 | CIF | C27 H29 Br N O6 P | P 1 | 10.2391; 11.4922; 24.9637 91.304; 98.318; 114.935 | 2624.1 | 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), 2015, 6, 6086-6090 |
1529799 | CIF | O8 Se2 Te2 | P 1 | 4.356; 6.701; 7.385 116.79; 106.78; 90.71 | 181.654 | 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-), 1982, 295, 981-983 |
1530014 | CIF | F4 N O3 Rb Te | P 1 | 8.216; 8.454; 10.794 109.09; 89.89; 111.18 | 654.867 | 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)), 1984, 10, 340-349 |
1530118 | CIF | I K O3 | P 1 | 7.71; 7.701; 7.698 109.06; 109.27; 109.29 | 355.253 | Kalinin, V.P.; Ilyukhin, V.V.; Belov, N.V. About the crystal structure of the triclinic modification of potassium iodate Doklady Akademii Nauk SSSR, 1978, 239, 590-593 |
1530127 | CIF | Rb S2 Sb | P 1 | 6.473; 6.473; 12.439 103.58; 101.77; 104.04 | 472.293 | 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), 1977, 18, 1069-1072 |
1530347 | CIF | B F4 H2 N3 S3 | P 1 | 5.445; 7.346; 9.473 85.89; 83.92; 82.13 | 372.601 | 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, 1984, 62, 1822-1827 |
1530392 | CIF | C29 H44 O4 | P 1 | 7.357; 11.5004; 15.8083 101.789; 102.383; 90.228 | 1277.24 | 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, 2015, 17, 4616-4619 |
1530486 | CIF | Ca Ge2 O5 | P 1 | 5.416; 5.517; 6.858 104.89; 102.05; 106.8 | 180.495 | 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, 1979, 246, 1123-1126 |
1530575 | CIF | Pb4 S13 Sb6 | P 1 | 16.56; 17.69; 3.982 91.09; 96.46; 96.77 | 1150.41 | 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, 1978, 241, 88-90 |
1530579 | CIF | Ca2 H K2 Na O20 Si7 Ti | P 1 | 10.35; 12.17; 7.05 91; 99.33; 92.5 | 875.162 | 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, 1971, 198, 575-578 |
1530758 | CIF | Ce4 H18 Na2 O24 Si2 Ti2 | P 1 | 7.57; 13.98; 5.03 101.5; 70.417; 101.5 | 486.368 | Shumyatskaya, N.G.; Voronkov, A.A.; Ilyukhin, V.V.; Belov, N.V. Crystal structure of tundrite Doklady Akademii Nauk SSSR, 1969, 185, 1289-1292 |
1530810 | CIF | Al H16 I3 O17 | P 1 | 7.473; 8.392; 13.574 89.93; 87.62; 63.58 | 761.563 | Sorokina, N.I.; Ilyukhin, V.V.; Kalinin, V.R.; Belov, N.V. The crystal structure of aluminium iodate octahydrate Doklady Akademii Nauk SSSR, 1979, 247, 360-363 |
1530953 | CIF | Ge2 La2 O7 | P 1 | 7.08; 7.101; 6.928 87.74; 91.25; 115.81 | 313.312 | 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, 1988, 73, 287-297 |
1531039 | CIF | C70.45 H104.45 Cl13.38 N8 O12.05 | P 1 | 14.3767; 24.3477; 24.5528 90.131; 93.427; 91.09 | 8577.5 | 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., 2016, 7, 183 |
1531687 | CIF | H28 Na7 O38 V W6 | P 1 | 7.997; 11.146; 11.328 60.89; 73.96; 83.62 | 847.506 | 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, 2001, 46, 1076-1080 |
1531993 | CIF | Al H4 O6 P | P 1 | 9.1851; 9.464; 9.5281 94.511; 102.89; 95.751 | 798.953 | 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, 2002, 106, 8599-8608 |
1532192 | CIF | Al2 Ca H8 O20 Si6 | P 1 | 6.71; 13.985; 10.032 89.96; 111.14; 90.01 | 878.042 | 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-), 2002, 66, 409-420 |
1533364 | CIF | C70 Sm2.78 | P 1 | 14.408; 9.723; 10.592 90; 96.205; 90 | 1475.13 | 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-), 2003, 67, 094101-1-094101-9 |
1533461 | CIF | C5 H22 Cl N10 Np O12 | P 1 | 9.134; 10.748; 11.762 114.32; 90.33; 90.46 | 1052.15 | 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, 2002, 44, 415-419 |
1534438 | CIF | Cl7 Fe Se | P 1 | 6.385; 8.242; 9.83 85.91; 102.62; 96.7 | 500.799 | 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, 1991, 36, 2541-2548 |
1534442 | CIF | Cl7 Fe Te | P 1 | 6.539; 8.388; 9.966 86.12; 102.72; 97.46 | 528.266 | 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, 1991, 36, 2541-2548 |
1534445 | CIF | Br7 Fe Te | P 1 | 6.796; 8.769; 10.435 85.71; 102.63; 97.06 | 601.478 | 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, 1991, 36, 2541-2548 |
1534661 | CIF | H0.5 Na5.5 O22 P4 U3 | P 1 | 6.675; 6.922; 10.732 83.96; 82.29; 89.44 | 488.65 | 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, 1980, 251, 385-389 |
1534803 | CIF | Ba3 O6 W | P 1 | 6.1072; 6.1071; 8.671 90.02; 89.98; 90.04 | 323.405 | 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, 1991, 36, 456-459 |
1535346 | CIF | Cs10 K6 Pb36 | P 1 | 9.843; 15.155; 15.289 104.51; 97.63; 99.55 | 2140.71 | 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, 2002, 21, 641-649 |
1535858 | CIF | C6 H2 K3 N9 O | P 1 | 3.72911; 8.092; 10.1222 71.2085; 80.5242; 86.6534 | 285.216 | 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, 2002, 4, 1305-1311 |
1535862 | CIF | C6 H2 N9 O Rb3 | P 1 | 3.93168; 8.26477; 10.36279 70.7984; 81.8717; 87.5042 | 314.803 | 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, 2002, 4, 1305-1311 |
1535873 | CIF | Cl3 H16 Mg N O6 | P 1 | 6.665; 13.301; 6.665 89.92; 91.52; 89.99 | 590.652 | 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), 1983, 51, 419-422 |
1536384 | CIF | Cl4 Cs2 Hg | P 1 | 7.519; 9.722; 26.759 89.97; 90.1; 90.11 | 1956.07 | 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, 1992, 37, 1447-1454 |
1536389 | CIF | O2 Si | P 1 | 4.916; 4.917; 5.407 90; 90; 120 | 113.188 | 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, 1993, 38, 44-50 |
1536429 | CIF | Cs15 H12 La3 O78 P24 | P 1 | 12.188; 14.74; 14.847 60.87; 66.35; 77.54 | 2133.53 | 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, 1995, 40, 374-380 |
1536545 | CIF | H4 Na7.23 O26 P2 Si4 Ti4 | P 1 | 5.351; 7.131; 14.488 102.1; 95.24; 90 | 538.188 | Khalilov, A.D. Refinement of crystal structure of betalomonosovite from Lovozerskii alkaline mine Mineralogiceskij Zhurnal, 1990, 12, 10-18 |
1536585 | CIF | Al17 Ba45 Cu28 F197 | P 1 | 14.024; 23.778; 25.48 90.44; 90.26; 107.03 | 8123.62 | 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, 2002, 628, 191-197 |
1536629 | CIF | Mo0.97 O5 V0.95 | P 1 | 6.334; 4.0463; 3.7255 90; 107.3; 90.5 | 91.158 | 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), 1991, 32, 110-115 |
1536716 | CIF | Ba F12 Sb2 | P 1 | 4.885; 5.074; 8.627 104.7; 100.25; 116.5 | 174.317 | Popov, A.I.; Val'kovskii, M.D.; Sukhoverkhov, V.F. Structure of fluoroantimonates(V) and fluorobismuthates(V) of alkaline earth metals Zhurnal Neorganicheskoi Khimii, 1990, 35, 2831-2836 |
1536883 | CIF | Ca4.7 Ce0.1 F2 Fe0.1 H Mn0.1 Na2 O16 Si4 Ti | P 1 | 9.584; 7.267; 5.708 89.85; 101.22; 101.03 | 382.496 | Rastsvetaeva, R.K.; Pushcharovskii, D.Yu.; Atencio, D. Crystal structure of giannetite Kristallografiya, 1995, 40, 626-630 |
1536900 | CIF | H6 O5 Sr Zn | P 1 | 6.245; 6.298; 7.838 105.39; 65.15; 108.63 | 261.975 | 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)), 1990, 16, 1255-1259 |
1539580 | CIF | O9 Ti5 | P 1 | 5.569; 7.12; 8.865 97.55; 112.34; 108.5 | 295.326 | Andersson, S. The crystal structure of Ti5 O9 Acta Chemica Scandinavica (1-27,1973-42,1988), 1960, 14, 1161-1172 |
1539962 | CIF | H O10 P3 Pb2 | P 1 | 7.77; 5.97; 6.93 135.1; 105.8; 67.4 | 209.486 | Worzala, H.; Jost, K.H. Die Kristallstruktur des Bleimonohydrogentriphosphats, Pb2 H P3 O10 Zeitschrift fuer Anorganische und Allgemeine Chemie, 1978, 445, 36-46 |
1540608 | CIF | C32 H37 Br Cl N3 O6 S2 | P 1 | 9.9554; 13.0776; 14.9103 75.045; 78.893; 69.659 | 1747.12 | 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, 2015, 17, 5614-5617 |
1540626 | CIF | C54 H78 Mo N2 O2 | P 1 | 10.0435; 10.3143; 12.8862 74.5019; 87.313; 78.6415 | 1261.15 | 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, 2015, 5, 1928 |
1540720 | CIF | C27 H38 O4 | P 1 | 7.234; 10.321; 19.308 85.37; 79.85; 69.87 | 1332 | 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, 2016, 79, 116-125 |
1540955 | CIF | As K Se2 | P 1 | 6.558; 12.628; 6.554 100.43; 107.53; 100.48 | 492.567 | 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, 1988, 561, 139-148 |
1541620 | CIF | Ca2 F Na O8 Si2 Ti | P 1 | 18.9; 7.47; 5.68 90; 90; 101.33 | 786.292 | 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, 1963, 150, 162-164 |
1541907 | CIF | C55 H82 N2 O8 S | P 1 | 5.385; 9.274; 25.69 92.65; 95.509; 93.348 | 1273 | Nuthanakanti, Ashok; Srivatsan, Seergazhi G. Hierarchical self-assembly of switchable nucleolipid supramolecular gels based on environmentally-sensitive fluorescent nucleoside analogs. Nanoscale, 2016, 8, 3607-3619 |
1541908 | CIF | C51 H74 N2 O8 S | P 1 | 5.4174; 9.3296; 24.033 95.858; 92.994; 93.33 | 1204.23 | Nuthanakanti, Ashok; Srivatsan, Seergazhi G. Hierarchical self-assembly of switchable nucleolipid supramolecular gels based on environmentally-sensitive fluorescent nucleoside analogs. Nanoscale, 2016, 8, 3607-3619 |
1541909 | CIF | C50.5 H79.5 N2.5 O9.5 | P 1 | 8.671; 11.183; 27.36 94.389; 97.977; 109.553 | 2454 | Nuthanakanti, Ashok; Srivatsan, Seergazhi G. Hierarchical self-assembly of switchable nucleolipid supramolecular gels based on environmentally-sensitive fluorescent nucleoside analogs. Nanoscale, 2016, 8, 3607-3619 |
1541910 | CIF | C46.5 H71.5 N2.5 O9.5 | P 1 | 8.615; 11.124; 25.315 101.343; 91.424; 109.601 | 2229.9 | Nuthanakanti, Ashok; Srivatsan, Seergazhi G. Hierarchical self-assembly of switchable nucleolipid supramolecular gels based on environmentally-sensitive fluorescent nucleoside analogs. Nanoscale, 2016, 8, 3607-3619 |
1542283 | CIF | C12 H26 In2 O6 | P 1 | 6.9927; 8.3025; 8.4128 76.086; 83.924; 87.628 | 471.36 | 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., 2016, 7, 2022 |
1542333 | CIF | C32 H32 O6 P2 | P 1 | 8.4358; 8.6021; 9.8323 104.212; 98.226; 96.026 | 677.2 | Bigler, Raphael; Mezzetti, Antonio Highly Enantioselective Transfer Hydrogenation of Polar Double Bonds by Macrocyclic Iron(II)/(NH)2P2Catalysts Organic Process Research & Development, 2016, 20, 253 |
1542352 | CIF | C52 H72 N4 O19 | P 1 | 11.4197; 15.8645; 16.2611 66.72; 86.95; 71.548 | 2558.26 | 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, 2016, 20, 233 |
1542484 | CIF HKL | C14 H28 N2 O8 S2 | P 1 | 5.0283; 5.058; 20.8394 86.645; 83.338; 68.908 | 491.08 | 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, 2016, 1, x152459 |
1542538 | CIF | C24 H32 F6 N8 O6 S2 Zn | P 1 | 8.3731; 8.6907; 11.7281 68.851; 81.968; 82.401 | 785.04 | 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., 2016, 6, 4824 |
1542542 | CIF HKL Paper | C16 H22 N2 O7 | P 1 | 6.778; 6.953; 9.458 109.182; 93.369; 98.437 | 413.7 | Numata, Takashi; Ikenomoto, Shun; Akitsu, Takashiro 4,4'-(1,2-Diazaniumylethane-1,2-diyl)dibenzoate trihydrate IUCrData, 2016, 1, x160252 |
1542570 | CIF | C13 H10 Cl N O2 | P 1 | 7.02512; 8.17982; 10.0807 104.135; 104.019; 91.6954 | 542.58 | 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, 2016, 18, 1270-1273 |
1542738 | CIF | C14 H6 N2 O2 | P 1 | 6.061; 3.384; 11.575 90; 90; 90 | 237.4 | 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, 1985, 24, 159-179 |
1542739 | CIF | C14 H6 N2 S2 | P 1 | 6.044; 3.417; 12.194 90; 90; 90 | 251.8 | 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, 1985, 24, 159-179 |
1542862 | CIF | C19 H20 Cl2 Cu N4 O9 | P 1 | 8.8284; 10.076; 14.925 76.39; 78.81; 66.84 | 1178.7 | 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, 2016, 441, 86-94 |
1542911 | CIF | C21 H17 N O7 | P 1 | 8.914; 10.559; 10.6874 82.779; 72.066; 70.261 | 900.55 | 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., 2016, 6, 4686 |
1543030 | CIF | C10 H12 B N O4 S | P 1 | 5.8323; 6.989; 13.7431 97.28; 98.85; 91.576 | 548.43 | Bandyopadhyay, Anupam; Cambray, Samantha; Gao, Jianmin Fast and selective labeling of N-terminal cysteines at neutral pH via thiazolidino boronate formation. Chemical science, 2016, 7, 4589-4593 |
1543066 | CIF HKL Paper | C18 H26 Cl2 N2 O | P 1 | 9.9172; 10.001; 10.4124 86.863; 84.173; 66.037 | 938.73 | Benharref, Ahmed; Oukhrib, Abdelouhed; Ait Elhad, Mustapha; Daran, Jean-Claude; Berraho, Moha <i>N</i>'-[(1<i>S</i>,3<i>R</i>,8<i>R</i>)-2,2-Dichloro-3,7,7,10-tetramethyltricyclo[6.4.0.0^1,3^]dodecan-11-yl]acetohydrazide IUCrData, 2016, 1, x160554 |
1543124 | CIF | C29 H21 Br N2 O3 S | P 1 | 9.8056; 10.1342; 13.2604 106.4; 94.409; 93.758 | 1255.1 | Hu, Zhiyong; Tong, Xiaofeng; Liu, Guixia Rhodium(III)-Catalyzed Cascade Cyclization/Electrophilic Amidation for the Synthesis of 3-Amidoindoles and 3-Amidofurans. Organic letters, 2016, 18, 2058-2061 |
1543218 | CIF | C22 H23 N O5 | P 1 | 7.8503; 11.0271; 17.767 75.302; 81.673; 89.125 | 1471.6 | 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, 2016, 18, 2383-2386 |
1543317 | CIF | C24 H19 Br N2 O2 S | P 1 | 11.3141; 13.0066; 13.3059 107.027; 97.7315; 113.173 | 1650.25 | Kikuchi, Jun; Momiyama, Norie; Terada, Masahiro Chiral Phosphoric Acid Catalyzed Diastereo- and Enantioselective Mannich-Type Reaction between Enamides and Thiazolones. Organic letters, 2016, 18, 2521-2523 |
1543335 | CIF | C18 H17 N O6 | P 1 | 17.138; 9.7525; 13.831 90; 134.45; 90 | 1650.2 | 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, 2016, 79, 1373-1380 |
1543336 | CIF | C20 H23 N O7 | P 1 | 11.6293; 9.9961; 16.9428 90; 93.84; 90 | 1965.14 | 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, 2016, 79, 1373-1380 |
1543356 | CIF | C29 H22 O4 | P 1 | 5.105; 9.985; 11.8359 65.909; 85.15; 82.591 | 545.829 | 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, 2016, 18, 2672-2675 |
1543772 | CIF | C40 H34 N4 O2 | P 1 | 5.559; 11.24; 13.638 75.767; 83.93; 81.445 | 814.7 | 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, 2017, 8, 142-149 |
1543791 | CIF | C56 H68 Cl F14 N7 O2 S2 | P 1 | 9.7657; 12.7259; 26.975 86.183; 83.556; 70.327 | 3135.3 | 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, 2016, 18, 3214-3217 |
1543829 | CIF | C26 H32 O5 | P 1 | 7.2748; 12.323; 13.1676 114.212; 90.277; 91.395 | 1076.14 | 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, 2016, 18, 2894-2897 |
1544035 | CIF | C20 H14 N4 O2 S2 | P 1 | 5.3047; 9.4281; 10.3733 73.857; 79.443; 83.488 | 488.84 | 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, 2016, 6, 89 |
1544242 | CIF | C16 H17 N O2 | P 1 | 8.164; 8.507; 19.437 90.22; 90.11; 90.19 | 1349.9 | 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, 2016, 15, 1385-1392 |
1544495 | CIF | Ca0.47 Co O2 | P 1 | 4.924; 5.683; 5.685 75.4; 89.974; 81.261 | 152.04 | 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, 2009, 117, 42-46 |
1544941 | CIF | C26 H28 Cl2 O8 S2 | P 1 | 7.5065; 8.2625; 12.1071 93.086; 105.999; 96.045 | 715.11 | Wallbaum, Jan; Garve, Lennart K. B.; Jones, Peter G.; Werz, Daniel B. Ring-Opening 1,3-Halochalcogenation of Cyclopropane Dicarboxylates. Organic letters, 2017, 19, 98-101 |
1545020 | CIF | C22 H22 O5 | P 1 | 5.5512; 8.9374; 19.4754 102.143; 93.557; 90.362 | 942.61 | 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 |
1545029 | CIF | C20 H24 N O5.5 P | P 1 | 8.8456; 13.4959; 17.587 92.181; 98.685; 106.652 | 1981.1 | 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, 2017, 19, 476-479 |
1545091 | CIF | C18 H17 F5 N O5 P | P 1 | 5.2533; 12.0015; 16.3874 74.879; 84.088; 80.148 | 980.85 | 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., 2017, 8, 2804 |
1545093 | CIF | C54 H51 Cl O2 Ru | P 1 | 10.9092; 12.5543; 15.2599 86.71; 83.989; 89.249 | 2074.99 | Kossler, D.; Cramer, N. Neutral chiral cyclopentadienyl Ru(ii)Cl catalysts enable enantioselective [2+2]-cycloadditions Chem. Sci., 2017, 8, 1862 |
1545162 | CIF | C53 H90 N10 O11 | P 1 | 9.302; 9.7698; 16.9249 84.505; 86.765; 71.597 | 1452.19 | 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, 2017, 8, 3007-3018 |
1545180 | CIF | C10 H15.5 N4 O6.75 S | P 1 | 8.0883; 10.9716; 16.0771 72.07; 80.273; 86.279 | 1337.78 | Rovira, Alexander R.; Fin, Andrea; Tor, Yitzhak Expanding a fluorescent RNA alphabet: synthesis, photophysics and utility of isothiazole-derived purine nucleoside surrogates. Chemical science, 2017, 8, 2983-2993 |
1545299 | CIF | C23 H24 Cl2 Co N5 O2 P | P 1 | 7.881; 8.61; 10.582 101.612; 110.925; 103.559 | 619 | Chen, Huafeng; Pan, Weijing; Huang, Kuo-Wei; Zhang, Xuequan; Gong, Dirong Controlled polymerization of isoprene promoted by a type of hemilabile XPN3 (X = O, S) ligand supported cobalt(ii) complexes: the role of a hemilabile donor on the level of control Polym. Chem., 2017, 8, 1805 |
1545431 | CIF | C11 H9.5 F1.5 O2 S | P 1 | 9.239; 9.369; 13.014 69.214; 85.843; 82.923 | 1044.6 | 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, 2017, 19, 1036-1039 |
1545571 | CIF | C63 H101 O23 | P 1 | 11.5223; 11.5593; 14.854 109.544; 94.088; 113.055 | 1668.16 | 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, 2017, 80, 1102-1109 |
1545773 | CIF | C22 H19 F3 O3 | P 1 | 8.7678; 10.7305; 10.8657 67.757; 88.911; 87.411 | 945.24 | 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 |
1545887 | CIF | C28 H28 N2 O10 | P 1 | 7.3394; 12.4108; 14.7998 107.312; 100.068; 91.14 | 1263.48 | Schneider, Lisa M.; Schmiedel, Volker M.; Pecchioli, Tommaso; Lentz, Dieter; Merten, Christian; Christmann, Mathias Asymmetric Synthesis of Carbocyclic Propellanes. Organic letters, 2017 |
1546200 | CIF | C30.5 H60.33333 O5.83333 | P 1 | 14.9136; 14.9888; 22.7918 97.926; 93.125; 114.454 | 4558.1 | Niu, Biao; Ke, Chang-Qiang; Li, Bo-Han; Li, Yuanyuan; Yi, Yongji; Luo, Yongwei; Shuai, Lin; Yao, Sheng; Lin, Li-Gen; Li, Jia; Ye, Yang Cucurbitane Glucosides from the Crude Extract of Siraitia grosvenorii with Moderate Effects on PGC-1α Promoter Activity. Journal of natural products, 2017, 80, 1428-1435 |
1546516 | CIF | C11 H12 F3 N O | P 1 | 5.0215; 8.6681; 12.6928 80.344; 83.072; 88.4 | 540.66 | Noto, Naoki; Koike, Takashi; Akita, Munetaka Metal-free di- and tri-fluoromethylation of alkenes realized by visible-light-induced perylene photoredox catalysis Chem. Sci., 2017 |
1546664 | CIF HKL Paper | C67 H72 B Br Fe N2 O P2 | P 1 | 12.8083; 14.637; 18.9082 106.916; 98.406; 110.635 | 3048.9 | Smith, Samantha A. M.; Lough, Alan J.; Morris, Robert H. Bromidocarbonyl{(1<i>S</i>,2<i>S</i>)-<i>N</i>-[2-(dicyclohexylphosphanyl)ethylidenyl]-<i>N</i>'-[2-(diphenylphosphanyl)ethyl]-1,2-diphenylethane-1,2-diamine}iron(II) tetraphenylborate IUCrData, 2017, 2, x170452 |
1546750 | CIF | C71 H60 B Br Fe N2 O P2 | P 1 | 11.301; 14.448; 19.278 110.941; 97.709; 101.33 | 2809.8 | Demmans, Karl Z.; Seo, Chris S. G.; Lough, Alan J.; Morris, Robert H. From imine to amine: an unexpected left turn. Cis-β iron(ii) PNNP′ precatalysts for the asymmetric transfer hydrogenation of acetophenone Chem. Sci., 2017 |
1546779 | CIF | C25 H37 F O5 | P 1 | 6.6282; 12.7871; 29.3443 81.5019; 84.6748; 75.0869 | 2373.02 | Bume, Desta Doro; Pitts, Cody Ross; Ghorbani, Fereshte; Harry, Stefan Andrew; Capilato, Joseph N.; Siegler, Maxime A.; Lectka, Thomas Ketones as Directing Groups in Photocatalytic sp3 C-H Fluorination Chem. Sci., 2017 |
1546958 | CIF | C18 H16 O5 | P 1 | 5.088; 11.946; 23.4043 90; 90; 90 | 1422.54 | Xu, Liangxiong; Wu, Ping; Xue, Jinghua; Molnar, Istvan; Wei, Xiaoyi Antifungal and Cytotoxic β-Resorcylic Acid Lactones from a Paecilomyces Species. Journal of natural products, 2017, 80, 2215-2223 |
1547020 | CIF | C24 H29 Cl2 N O4 | P 1 | 7.3804; 9.68; 16.898 87.64; 86.23; 89.091 | 1203.5 | Fan, Shiming; Liu, Shouxin; Zhu, Sufang; Feng, Juan; Zhang, Zhiwei; Huang, Jing Temperature-Dependent Enantio- and Diastereodivergent Synthesis of Amino Acids with One or Multiple Chiral Centers. Organic letters, 2017, 19, 4660-4663 |
1547024 | CIF | C16 H25 N O3 | P 1 | 10.9576; 10.9859; 13.5339 99.194; 98.907; 102.923 | 1536.48 | Fan, Shiming; Liu, Shouxin; Zhu, Sufang; Feng, Juan; Zhang, Zhiwei; Huang, Jing Temperature-Dependent Enantio- and Diastereodivergent Synthesis of Amino Acids with One or Multiple Chiral Centers. Organic letters, 2017, 19, 4660-4663 |
1547081 | CIF | C17 H18 N4 O3 | P 1 | 8.8973; 10.3854; 10.5682 113.149; 92.819; 112.907 | 803.17 | Bernar, Ivan; Fiser, Béla; Blanco-Ania, Daniel; Gómez-Bengoa, Enrique; Rutjes, Floris P. J. T. Pd-Catalyzed Hydroamination of Alkoxyallenes with Azole Heterocycles: Examples and Mechanistic Proposal. Organic letters, 2017, 19, 4211-4214 |
1547089 | CIF | C19 H25 N3 O7 S | P 1 | 5.8603; 8.7507; 19.9834 95.115; 90.454; 97.456 | 1011.87 | Prasad, Sure Siva; Senthilkumar, Soundararasu; Srivastava, Akriti; Baskaran, Sundarababu Iminosugar C-Nitromethyl Glycosides and Divergent Synthesis of Bicyclic Iminosugars. Organic letters, 2017, 19, 4403-4406 |
1547093 | CIF | C21 H22 N2 O7 | P 1 | 7.5; 10.984; 12.966 79.535; 87.356; 75.611 | 1017.4 | Read, Jacquelyne A.; Yang, Yingying; Woerpel, K. A. Additions of Organomagnesium Halides to α-Alkoxy Ketones: Revision of the Chelation-Control Model. Organic letters, 2017, 19, 3346-3349 |
1547125 | CIF | C26 H26 N4 O5 | P 1 | 7.2089; 8.081; 20.594 81.103; 84.522; 84.478 | 1175.8 | Kadam, Abhishek A.; Ellern, Arkady; Stanley, Levi M. Enantioselective, Palladium-Catalyzed Conjugate Additions of Arylboronic Acids to Form Bis-benzylic Quaternary Stereocenters. Organic letters, 2017, 19, 4062-4065 |
1547230 | CIF | C19 H19 N O | P 1 | 8.4979; 9.606; 9.7613 90.716; 105.714; 100.679 | 752.1 | Hu, Yue; Huang, Hanmin Highly Selective Construction of Medium-Sized Lactams by Palladium-Catalyzed Intramolecular Hydroaminocarbonylation of Aminoalkynes. Organic letters, 2017, 19, 5070-5073 |
1547565 | CIF | C46 H11 Cl5 F20 S4 | P 1 | 8.198; 10.441; 13.934 101.832; 96.687; 104.041 | 1115 | Panchal, Santosh P.; Anand, Venkataramanarao G. Oxidative Transformation of a Tetrathia S-Confused Isophlorin into Porphyrin Cation. Organic letters, 2017, 19, 4854-4857 |
1547567 | CIF | C15 H14 O3 S | P 1 | 7.8451; 8.3042; 11.06 76.583; 88.533; 75.925 | 679.46 | Xia, Jingzhao; Nie, Yu; Yang, Guoqiang; Liu, Yangang; Zhang, Wanbin Iridium-Catalyzed Asymmetric Hydrogenation of 2H-Chromenes: A Highly Enantioselective Approach to Isoflavan Derivatives. Organic letters, 2017, 19, 4884-4887 |
1547576 | CIF | C21 H19 Br N2 O6 | P 1 | 7.04; 7.063; 10.762 83.24; 79.64; 79.5 | 515.6 | Yuan, Yang; Yu, Bo; Bai, Xing-Feng; Xu, Zheng; Zheng, Zhan-Jiang; Cui, Yu-Ming; Cao, Jian; Xu, Li-Wen Asymmetric Synthesis of Glutamic Acid Derivatives by Silver-Catalyzed Conjugate Addition-Elimination Reactions. Organic letters, 2017, 19, 4896-4899 |
1547701 | CIF | C21 H28 Br N O7 | P 1 | 5.8465; 9.7587; 9.8846 89.343; 87.738; 86.3034 | 562.324 | Horwitz, Matthew A.; Fulton, Jennifer L.; Johnson, Jeffrey S. Enantio- and Diastereoselective Organocatalytic Conjugate Additions of Nitroalkanes to Enone Diesters. Organic letters, 2017, 19, 5783-5785 |
1547853 | CIF | C19.5 H27 N2 O2 | P 1 | 9.0112; 9.8045; 10.2163 89.964; 78.459; 76.61 | 859.33 | Chong, Kam-Weng; Yeap, Joanne Soon-Yee; Lim, Siew-Huah; Weber, Jean-Frédéric F; Low, Yun-Yee; Kam, Toh-Seok Biosynthetic Enantiodivergence in the Eburnane Alkaloids from Kopsia. Journal of natural products, 2017, 80, 3014-3024 |
1547893 | CIF | C41 H72.5 N7 O13.25 | P 1 | 11.0081; 11.0439; 20.174 81.37; 78.531; 80.367 | 2352.4 | Sudipta Mondal; Maxim Varenik; Daniel Nir Bloch; Yoav Atsmon-Raz; Guy Jacoby; Lihi Adler-Abramovich; Linda J.W. Shimon; Roy Beck; Yifat Miller; Oren Regev; Ehud Gazit A minimal length rigid helical peptide motif allows rational design of modular surfactants Nature Communications, 2017, 8, 14018 |
1547898 | CIF | C20 H50 Al2 Cl12 Mg3 O10 | P 1 | 12.3498; 16.4651; 35.607 80.016; 81.571; 85.031 | 7039.7 | Salama, Michael; Shterenberg, Ivgeni; J.W. Shimon, Linda; Keinan-Adamsky, Keren; Afri, Michal; Gofer, Yosef; Aurbach, Doron Structural Analysis of Magnesium Chloride Complexes in Dimethoxyethane Solutions in the Context of Mg Batteries Research The Journal of Physical Chemistry C, 2017, 121, 24909 |
1547925 | CIF | C21 H21 N O | P 1 | 6.1157; 7.6877; 35.725 88.193; 85.251; 82.371 | 1658.7 | Lim, Ngiap-Kie; Weiss, Patrick; Li, Beryl X.; McCulley, Christina H.; Hare, Stephanie R.; Bensema, Bronwyn L.; Palazzo, Teresa A.; Tantillo, Dean J.; Zhang, Haiming; Gosselin, Francis Synthesis of Highly Stereodefined Tetrasubstituted Acyclic All-Carbon Olefins via a Syn-Elimination Approach. Organic letters, 2017, 19, 6212-6215 |
1548037 | CIF | C30 H50 N6 O9 | P 1 | 4.9205; 11.812; 14.637 99.369; 93.376; 98.82 | 826.4 | Tom Guterman; Micha Kornreich; Avigail Stern; Lihi Adler-Abramovich; Danny Porath; Roy Beck; Linda J. W. Shimon; Ehud Gazit Formation of bacterial pilus-like nanofibres by designed minimalistic self-assembling peptides Nature Communications, 2016, 7, 13482 |
1548075 | CIF | C38 H80 As2 Ge2 K2 N6 O12 | P 1 | 10.9738; 11.9313; 12.6146 118.021; 108.361; 96.476 | 1315.07 | Stefan Mitzinger; Lies Broeckaert; Werner Massa; Florian Weigend; Stefanie Dehnen Understanding of multimetallic cluster growth Nature Communications, 2016, 7, 10480 |
1548294 | CIF | C27 H26 O5 S | P 1 | 4.6598; 11.2839; 12.0321 115.307; 97.601; 94.255 | 560.85 | Pratap S. Patil; Ting-Jen Rachel Cheng; Medel Manuel L. Zulueta; Shih-Ting Yang; Larry S. Lico; Shang-Cheng Hung Total synthesis of tetraacylated phosphatidylinositol hexamannoside and evaluation of its immunomodulatory activity Nature Communications, 2015, 6, 7239 |
1548328 | CIF | C20 H17 N O2 | P 1 | 7.3007; 10.496; 10.861 70.26; 77; 81.658 | 761.1 | Zhang, Dewu; Guo, Jiamei; Zhang, Min; Liu, Xiao; Ba, Mingyu; Tao, Xiaoyu; Yu, Liyan; Guo, Ying; Dai, Jungui Oxazole-Containing Diterpenoids from Cell Cultures of Salvia miltiorrhiza and Their Anti-HIV-1 Activities. Journal of natural products, 2017, 80, 3241-3246 |
1548358 | CIF | C21 H28 Cl6 O3 | P 1 | 6.315; 9.3352; 11.1622 104.386; 95.464; 107.774 | 596.44 | Mino R. Caira; Susan A. Bourne; Halima Samsodien Thermal, X-ray Structural, and Dissolution Characteristics of Solid Forms Derived from the Anticancer Agents 2-Methoxyestradiol and 2-Methoxyestradiol-3,17-O,O-Bis-Sulfamate Journal of Pharmaceutical Sciences, 2015, 104, 3418-3425 |
1548386 | CIF | C58 H53 Ag5 F6 N17 O6 S2 | P 1 | 12.278; 25.145; 12.408 90; 117.31; 90 | 3403.7 | He, Xin; Xue, Yang; Li, Cui-Cui; Wang, Yuechao; Jiang, Hong; Zhao, Liang Synthesis of stable polymetalated aromatic complexes through metal-macrocycle capsule-triggered cyclization. Chemical science, 2018, 9, 1481-1487 |
1548394 | CIF | Bi9 Mn5.571 O20.143 | P 1 | 27.72; 27.72; 39.4 90; 90; 120 | 26218.8 | Li, Leigang; Boullay, Philippe; Lu, Ping; Wang, Xuejing; Jian, Jie; Huang, Jijie; Gao, Xingyao; Misra, Shikhar; Zhang, Wenrui; Perez, Olivier; Steciuk, Gwladys; Chen, Aiping; Zhang, Xinghang; Wang, Haiyan Novel Layered Supercell Structure from Bi2AlMnO6 for Multifunctionalities. Nano letters, 2017, 17, 6575-6582 |
1548395 | CIF | Bi9 Mn5.571 O20.143 | P 1 | 27.72; 27.72; 78.8 90; 90; 120 | 52437.7 | Li, Leigang; Boullay, Philippe; Lu, Ping; Wang, Xuejing; Jian, Jie; Huang, Jijie; Gao, Xingyao; Misra, Shikhar; Zhang, Wenrui; Perez, Olivier; Steciuk, Gwladys; Chen, Aiping; Zhang, Xinghang; Wang, Haiyan Novel Layered Supercell Structure from Bi2AlMnO6 for Multifunctionalities. Nano letters, 2017, 17, 6575-6582 |
1548480 | CIF | C10 H16 N O3 | P 1 | 5.0728; 14.5938; 15.1058 83.648; 81.203; 83.714 | 1093.47 | Milan Bergeron-Brlek; Michael Meanwell; Robert Britton Direct synthesis of imino-C-nucleoside analogues and other biologically active iminosugars Nature Communications, 2015, 6, 6903 |
1548513 | CIF | C22 H30 O5 | P 1 | 9.3123; 11.7835; 11.8236 117.449; 110.752; 94.972 | 1026.64 | Cao, Jia-Qing; Tian, Hai-Yan; Li, Man-Mei; Zhang, Wei; Wang, Ying; Wang, Lei; Ye, Wen-Cai Rearranged Phloroglucinol-Monoterpenoid Adducts from Callistemon rigidus Journal of Natural Products, 2017 |
1548563 | CIF | C34 H43 N O5 S Si | P 1 | 10.6277; 11.3209; 15.3086 70.82; 77.972; 66.025 | 1583.5 | Zhanchao Meng; Haixin Yu; Li Li; Wanyin Tao; Hao Chen; Ming Wan; Peng Yang; David J. Edmonds; Jin Zhong; Ang Li Total synthesis and antiviral activity of indolosesquiterpenoids from the xiamycin and oridamycin families Nature Communications, 2015, 6, 6096 |
1548657 | CIF | C18 H17 Br N2 O2 | P 1 | 4.681; 6.1091; 14.2048 100.603; 92.652; 94.55 | 397.25 | Uno, Brice E.; Dicken, Rachel D.; Redfern, Louis R.; Stern, Charlotte M.; Krzywicki, Greg G.; Scheidt, Karl A. Calcium(ii)-catalyzed enantioselective conjugate additions of amines. Chemical science, 2018, 9, 1634-1639 |
1548693 | CIF | C22 H42 Br4 Cu2 N6 O2 S2 | P 1 | 7.988; 9.116; 11.625 86.69; 73.837; 80.279 | 801.3 | Musabbir A. Saeed; Douglas R. Powell; Md. Alamgir Hossain Fluorescent detection of phosphate anion by a highly selective chemosensor in water Tetrahedron Letters, 2010, 51, 4904-4907 |
1548838 | CIF | C18 H26 N4 O6 S | P 1 | 7.4225; 16.5812; 21.1102 82.789; 85.375; 84.403 | 2559.1 | Lee, Jisun; Joullié, Madeleine M Total synthesis of the reported structure of ceanothine D <i>via</i> a novel macrocyclization strategy. Chemical science, 2018, 9, 2432-2436 |
1549283 | CIF | C63 H59 B2 Co F24 I N6 O3 S | P 1 | 10.4248; 12.9027; 15.4799 101.302; 105.089; 113.446 | 1735.7 | Hill, Ethan A.; Kelty, Margaret L.; Filatov, Alexander S.; Anderson, John S. Isolable iodosylarene and iodoxyarene adducts of Co and their O-atom transfer and C-H activation reactivity. Chemical science, 2018, 9, 4493-4499 |
1549395 | CIF | C47 H36 Dy F9 N2 O6 | P 1 | 10.5005; 10.5156; 11.1246 83.611; 66.854; 74.875 | 1090.31 | Li, Xi-Li; Zhu, Cancan; Rong, Qixiang; Wei, Jiahao; Li, Ruixue; Liu, Cai-Ming A pair of mononuclear Dy(iii) enantiomers showing single-ion magnetic and ferroelectric properties New Journal of Chemistry, 2018, 42, 10906 |
1549396 | CIF | C47 H36 Dy F9 N2 O6 | P 1 | 10.4994; 10.5083; 11.1201 83.608; 66.819; 74.881 | 1088.75 | Li, Xi-Li; Zhu, Cancan; Rong, Qixiang; Wei, Jiahao; Li, Ruixue; Liu, Cai-Ming A pair of mononuclear Dy(iii) enantiomers showing single-ion magnetic and ferroelectric properties New Journal of Chemistry, 2018, 42, 10906 |
1549425 | CIF | C26 H40 N2 O6 | P 1 | 8.8976; 9.7399; 15.4155 93.972; 99.602; 107.215 | 1248.19 | Engstrom, Jordan R.; Savyasachi, Aramballi J.; Parhizkar, Marzieh; Sutti, Alessandra; Hawes, Chris S.; White, Jonathan M.; Gunnlaugsson, Thorfinnur; Pfeffer, Frederick M. Norbornene chaotropic salts as low molecular mass ionic organogelators (LMIOGs). Chemical science, 2018, 9, 5233-5241 |
1549588 | CIF | C17 H16 O2 Se | P 1 | 6.7562; 7.5182; 8.7692 107.83; 98.976; 113.06 | 370.28 | García-López, Diego; Civit, Marc G.; Vogels, Christopher M.; Ricart, Josep M.; Westcott, Stephen A.; Fernández, Elena; Carbó, Jorge J. Understanding the mechanism of transition metal-free anti addition to alkynes: the selenoboration case Catalysis Science & Technology, 2018, 8, 3617 |
1549842 | CIF | C69 H59 Br2 Co N9 O9 S2 | P 1 | 8.8042; 13.872; 15.012 113.273; 91.702; 108.265 | 1574.4 | Shao, Dong; Shi, Le; Yin, Lei; Wang, Bao-Lin; Wang, Zhen-Xing; Zhang, Yi-Quan; Wang, Xin-Yi Reversible on-off switching of both spin crossover and single-molecule magnet behaviours <i>via</i> a crystal-to-crystal transformation. Chemical science, 2018, 9, 7986-7991 |
1549843 | CIF | C69 H59 Br2 Co N9 O9 S2 | P 1 | 8.933; 14.009; 15.07 113.024; 91.175; 108.218 | 1627 | Shao, Dong; Shi, Le; Yin, Lei; Wang, Bao-Lin; Wang, Zhen-Xing; Zhang, Yi-Quan; Wang, Xin-Yi Reversible on-off switching of both spin crossover and single-molecule magnet behaviours <i>via</i> a crystal-to-crystal transformation. Chemical science, 2018, 9, 7986-7991 |
1549844 | CIF | C69 H55 Br2 Co N9 O7 S2 | P 1 | 8.7198; 13.8688; 15.15 112.076; 90.143; 106.456 | 1615.99 | Shao, Dong; Shi, Le; Yin, Lei; Wang, Bao-Lin; Wang, Zhen-Xing; Zhang, Yi-Quan; Wang, Xin-Yi Reversible on-off switching of both spin crossover and single-molecule magnet behaviours <i>via</i> a crystal-to-crystal transformation. Chemical science, 2018, 9, 7986-7991 |
1549845 | CIF | C69 H55 Br2 Co N9 O7 S2 | P 1 | 8.6715; 13.689; 15.1994 112.725; 90.764; 106.662 | 1578.49 | Shao, Dong; Shi, Le; Yin, Lei; Wang, Bao-Lin; Wang, Zhen-Xing; Zhang, Yi-Quan; Wang, Xin-Yi Reversible on-off switching of both spin crossover and single-molecule magnet behaviours <i>via</i> a crystal-to-crystal transformation. Chemical science, 2018, 9, 7986-7991 |
1549846 | CIF | C69 H59 Br2 Co N9 O9 S2 | P 1 | 8.8606; 13.9125; 14.9455 65.422; 87.897; 71.56 | 1579.8 | Shao, Dong; Shi, Le; Yin, Lei; Wang, Bao-Lin; Wang, Zhen-Xing; Zhang, Yi-Quan; Wang, Xin-Yi Reversible on-off switching of both spin crossover and single-molecule magnet behaviours <i>via</i> a crystal-to-crystal transformation. Chemical science, 2018, 9, 7986-7991 |
1549847 | CIF | C69 H55 Br2 Co N9 O7 S2 | P 1 | 8.6306; 13.5529; 15.2106 113.16; 91.252; 106.863 | 1546.66 | Shao, Dong; Shi, Le; Yin, Lei; Wang, Bao-Lin; Wang, Zhen-Xing; Zhang, Yi-Quan; Wang, Xin-Yi Reversible on-off switching of both spin crossover and single-molecule magnet behaviours <i>via</i> a crystal-to-crystal transformation. Chemical science, 2018, 9, 7986-7991 |
1549849 | CIF | C26 H32 N2 O8 S | P 1 | 6.25857; 10.36; 11.9013 64.561; 87.812; 84.16 | 693.22 | Liu, Yang; Liu, Xiangyuan; Li, Jiangtao; Zhao, Xiaowei; Qiao, Baokun; Jiang, Zhiyong Catalytic enantioselective radical coupling of activated ketones with <i>N</i>-aryl glycines. Chemical science, 2018, 9, 8094-8098 |
1549899 | CIF HKL Paper | C15 H14 N4 O3 | P 1 | 5.859; 7.479; 16.329 93.818; 91.29; 94.252 | 711.7 | Wang, Zhaodong; Ni, Haitao Methyl 4-{<i>N</i>'-[(1<i>E</i>)-1-(pyrazin-2-yl)ethylidene]hydrazinecarbonyl}benzoate IUCrData, 2018, 3, x181230 |
1550004 | CIF | C67 H10 Al F46 Fe O3 | P 1 | 11.6429; 11.6834; 12.0655 97.981; 101.382; 98.8 | 1565.64 | Kögel, Julius F; Timoshkin, Alexey Y.; Schröder, Artem; Lork, Enno; Beckmann, Jens Al(OCArF3)<sub>3</sub> - a thermally stable Lewis superacid. Chemical science, 2018, 9, 8178-8183 |
1550211 | CIF | C23 H26 B F2 N O4 | P 1 | 10.235; 10.796; 20.224 92.916; 103.825; 90.9 | 2166.2 | Louis, Marine; Sethy, Ramarani; Kumar, Jatish; Katao, Shouhei; Guillot, Régis; Nakashima, Takuya; Allain, Clémence; Kawai, Tsuyoshi; Métivier, Rémi Mechano-responsive circularly polarized luminescence of organic solid-state chiral emitters Chemical Science, 2019 |
1550336 | CIF HKL Paper | C9 H11 N O3 | P 1 | 4.8011; 6.5522; 7.5052 93.618; 107.044; 95.658 | 223.575 | Baillargeon, Pierre; Rahem, Tarik; Amigo, Carl; Fortin, Daniel; Dory, Yves L. Polar crystal of vanillylformamide through replacement of the alkene by an isosteric formamide group IUCrData, 2018, 3, x181630 |
1550423 | CIF | C60 H46 N8 O7 | P 1 | 9.1177; 10.6349; 13.6347 84.797; 86.884; 73.337 | 1260.8 | Gozálvez, Cristian; Zafra, José L.; Saeki, Akinori; Melle-Franco, Manuel; Casado Cordón, Juan; Mateo-Alonso, Aurelio Charge Transport Modulation in Pseudorotaxane 1D Stacks of Acene and Azaacene Derivatives Chemical Science, 2019 |
1550449 | CIF | C22 H32 N2 O9.5 P S | P 1 | 8.7929; 12.6645; 23.7867 82.3345; 81.4117; 89.9824 | 2595.2 | Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ, 2019, 6, 145-151 |
1550455 | CIF | C24 H38 N2 O8 | P 1 | 5.8213; 7.27088; 15.90214 94.7215; 96.6693; 109.525 | 624.781 | Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients IUCrJ, 2019, 6, 145-151 |
1550598 | CIF | Al2 H4 O9 Si2 | P 1 | 5.17375; 8.98502; 7.35224 91.6843; 105.128; 89.7549 | 329.789 | Richard, D.; Rendtorff, N. M. First principles study of structural properties and electric field gradients in kaolinite Applied Clay Science, 2019, 169, 67-73 |
1550837 | CIF | C32 H40 N4 O2 | P 1 | 10.1957; 12.2494; 23.2226 92.193; 93.573; 106.021 | 2777.6 | Qi, Qingkai; Chi, Weijie; Li, Yuanyuan; Qiao, Qinglong; Chen, Jie; Miao, Lu; Zhang, Yi; Li, Jin; Ji, Wei; Xu, Tao; Liu, Xiaogang; Yoon, Juyoung; Xu, Zhaochao A H-Bond Strategy to Develop Acid-Resistant Photoswitchable Rhodamine Spirolactams for Super-Resolution Single-Molecule Localization Microscopy Chemical Science, 2019 |
1550876 | CIF | C56 H56 Li2 N4 P2 | P 1 | 12.7; 12.756; 43.4 81.58; 88.39; 60.36 | 6037 | Feuerstein, Thomas J.; Goswami, Bhupendra; Rauthe, Pascal; Köppe, Ralf; Lebedkin, Sergei; Kappes, Manfred M.; Roesky, Peter W. Alkali metal complexes of an enantiopure iminophosphonamide ligand with bright delayed fluorescence Chemical Science, 2019, 10, 4742-4749 |
1551315 | CIF | Fe4 O5 | P 1 | 8.583; 39.2492; 12.5425 90; 90; 90 | 4225.3 | Sergey V. Ovsyannikov; Maxim Bykov; Elena Bykova; Denis P. Kozlenko; Alexander A. Tsirlin; Alexander E. Karkin; Vladimir V. Shchennikov; Sergey E. Kichanov; Huiyang Gou; Artem M. Abakumov; Ricardo Egoavil; Johan Verbeeck; Catherine McCammon; Vadim Dyadkin; Dmitry Chernyshov; Sander van Smaalen; Leonid S. Dubrovinsky Charge-ordering transition in iron oxide Fe4O5 involving competing dimer and trimer formation Nature Chemistry, 2016, 8, 501-508 |
1551345 | CIF | C312 H313 Cl24 N44 O50 | P 1 | 18.008; 18.419; 30.513 78.68; 88.33; 65.83 | 9039 | Soumen De; Bo Chi; Thierry Granier; Ting Qi; Victor Maurizot; Ivan Huc Designing cooperatively folded abiotic uni- and multimolecular helix bundles Nature Chemistry, 2018, 10, 51-57 |
1551346 | CIF | C112 H104 N18 O21 | P 1 | 25.286; 26.901; 27.418 108.71; 107.77; 109.81 | 14718 | Soumen De; Bo Chi; Thierry Granier; Ting Qi; Victor Maurizot; Ivan Huc Designing cooperatively folded abiotic uni- and multimolecular helix bundles Nature Chemistry, 2018, 10, 51-57 |
1551384 | CIF | C206 H209 N40 O40 | P 1 | 17.018; 19.782; 33.512 81.76; 88.25; 82.41 | 11067 | Nagula Chandramouli; Yann Ferrand; Guillaume Lautrette; Brice Kauffmann; Cameron David Mackereth; Michel Laguerre; Didier Dubreuil; Ivan Huc Iterative design of a helically folded aromatic oligoamide sequence for the selective encapsulation of fructose Nature Chemistry, 2015, 7, 334-341 |
1551582 | CIF | C12 H25 N O13 | P 1 | 6.914; 7.7202; 8.7383 79.467; 73.033; 67.106 | 409.71 | FUJIMOTO, Takashi; NISHIO, Toshiyuku; HOSAKA, Hiroki; MIZOGUCHI, Saori; TASHIRO, Mitsuru Crystal Structure of β-D-Fructofuranosyl-[2↔1]-6-amido-6-deoxy-α-D-glucopyranoside X-ray Structure Analysis Online, 2017, 33, 63 |
1551593 | CIF | C18 H21 Cl3 N3 O2.202 P | P 1 | 9.6898; 10.4576; 21.0199 83.6336; 89.3963; 73.819 | 2032.53 | ARIANI, Maral; POURAYOUBI, Mehrdad; DUŠEK, Michal; VAHDANI ALVIRI, Banafsheh; EIGNER, Václav; DAMODARAN, Krishnan Synthesis, Spectroscopic Study and Crystal Structure of a New Single-Enantiomer C(O)NHP(O)-based Phosphoric Triamide, CCl<sub>3</sub>C(O)NHP(O)[(R)-(+)-NHCH(CH<sub>3</sub>)(C<sub>6</sub>H<sub>5</sub>)]<sub>2</sub>·0.25H<sub>2</sub>O X-ray Structure Analysis Online, 2017, 33, 17 |
1551641 | CIF | C70 H88 B2 Cu N4 O4 | P 1 | 12.2123; 12.5684; 12.9841 100.526; 107.424; 116.156 | 1587.4 | MATSUI, Chihiro; OKAWARA, Toru; NAGAMURA, Toshihiko; TAKEHARA, Kenji Crystal Structure of Bis(acetone-<i>κ</i><i>O</i>)-1,4,8,11-tetraazacyclotetradecane Copper(II) Ditetraphenylborate Acetone Disolvate X-ray Structure Analysis Online, 2015, 31, 53 |
1551889 | CIF | C29 H31 F14 N O Si | P 1 | 8.6241; 9.7969; 18.9232 80.469; 83.314; 76.243 | 1526.55 | Mattia Silvi; Charlie Verrier; Yannick P. Rey; Luca Buzzetti; Paolo Melchiorre Visible-light excitation of iminium ions enables the enantioselective catalytic beta-alkylation of enals Nature Chemistry, 2017, 9, 868-873 |
1552063 | CIF | C39 H42 Br N O10 | P 1 | 8.0123; 9.5367; 12.5723 76.698; 83.324; 77.616 | 910.87 | Gang Liu; Morgan E. Shirley; Khoi N. Van; Rae Lynn McFarlin; Daniel Romo Rapid assembly of complex cyclopentanes employing chiral, alpha,beta-unsaturated acylammonium intermediates Nature Chemistry, 2013, 5, 1049-1057 |
1552277 | CIF | C26 H52 N6 O2 Pt S4 | P 1 | 6.189; 12.221; 12.196 86.03; 75.35; 79.55 | 877.396 | Bisceglie, Franco; Orsoni, Nicolò; Pioli, Marianna; Bonati, Beatrice; Tarasconi, Pieralberto; Rivetti, Claudio; Amidani, Davide; Montalbano, Serena; Buschini, Annamaria; Pelosi, Giorgio Cytotoxic activity of copper(ii), nickel(ii) and platinum(ii) thiosemicarbazone derivatives: interaction with DNA and the H2A histone peptide. Metallomics : integrated biometal science, 2019, 11, 1729-1742 |
1552374 | CIF | C16 Al F36 O4 Tl | P 1 | 9.6336; 10.4764; 16.8374 81.433; 73.486; 63.371 | 1455.95 | Weis, Philippe; Röhner, David C.; Prediger, Richard; Butschke, Burkhard; Scherer, Harald; Weber, Stefan; Krossing, Ingo First Experimental Evidence for the Elusive Tetrahedral Cations [EP3]+ in the Condensed Phase Chemical Science, 2019 |
1552489 | CIF | C26 H30 F3 N7 O9 | P 1 | 5.0591; 10.9615; 13.2 103.037; 90.846; 90.3108 | 713.03 | Policarpo, Rocco L.; Decultot, Ludovic; May, Elizabeth; Kuzmič, Petr; Carlson, Samuel; Huang, Danny; Chu, Vincent; Wright, Brandon A.; Dhakshinamoorthy, Saravanakumar; Kannt, Aimo; Rani, Shilpa; Dittakavi, Sreekanth; Panarese, Joseph D.; Gaudet, Rachelle; Shair, Matthew D. High-Affinity Alkynyl Bisubstrate Inhibitors of Nicotinamide <i>N</i>-Methyltransferase (NNMT). Journal of medicinal chemistry, 2019 |
1552492 | CIF | C28.5 H33 F3 N O6.5 | P 1 | 8.9167; 11.8688; 14.75 68.987; 73.43; 77.232 | 1384.3 | Tshitenge, Dieudonné Tshitenge; Bruhn, Torsten; Feineis, Doris; Schmidt, David; Mudogo, Virima; Kaiser, Marcel; Brun, Reto; Würthner, Frank; Awale, Suresh; Bringmann, Gerhard Ealamines A-H, a Series of Naphthylisoquinolines with the Rare 7,8'-Coupling Site, from the Congolese Liana <i>Ancistrocladus ealaensis</i>, Targeting Pancreatic Cancer Cells. Journal of natural products, 2019 |
1552558 | CIF | C27 H29 N5 O3 | P 1 | 8.6537; 8.8678; 16.7811 77.756; 82.545; 68.655 | 1170.2 | Guo, Yunhang; Liu, Ye; Hu, Nan; Yu, Desheng; Zhou, Changyou; Shi, Gongyin; Zhang, Bo; Wei, Min; Liu, Junhua; Luo, Lusong; Tang, Zhiyu; Song, Huipeng; Guo, Yin; Liu, Xuesong; Su, Dan; Zhang, Shuo; Song, Xiaomin; Zhou, Xing; Hong, Yuan; Chen, Shuaishuai; Cheng, Zhenzhen; Young, Steve; Wei, Qiang; Wang, Haisheng; Wang, Qiuwen; Lv, Lei; Wang, Fan; Xu, Haipeng; Sun, Hanzi; Xing, Haimei; Li, Na; Zhang, Wei; Wang, Zhongbo; Liu, Guodong; Sun, Zhijian; Zhou, Dongping; Li, Wei; Liu, Libin; Wang, Lai; Wang, Zhiwei Discovery of Zanubrutinib (BGB-3111), a Novel, Potent, and Selective Covalent Inhibitor of Bruton's Tyrosine Kinase. Journal of medicinal chemistry, 2019, 62, 7923-7940 |
1552571 | CIF | C36 H55 N O4 | P 1 | 7.3195; 16.8609; 21.8814 69.35; 87.717; 83.935 | 2512.8 | Wei, Wen-Jun; Song, Qiu-Yan; Ying, Jin-Chuan; Li, Hang-Ying; Ma, Kai-Liang; Li, Yida; Li, Ya; Gao, Kun Highly Oxygenated Triterpenoids and Rare Tetraterpenoids from <i>Abies chensiensis</i> and Their Antibacterial Activity. Journal of natural products, 2019, 82, 2859-2869 |
1552585 | CIF | C29.75 H38.75 O7.75 | P 1 | 9.3591; 12.5274; 12.547 74.614; 88.037; 88.948 | 1417.45 | Su, Jun-Cheng; Cheng, Wen; Song, Jian-Guo; Zhong, Yuan-Lin; Huang, Xiao-Jun; Jiang, Ren-Wang; Li, Yao-Lan; Li, Man-Mei; Ye, Wen-Cai; Wang, Ying Macrocyclic Diterpenoids from <i>Euphorbia helioscopia</i> and Their Potential Anti-inflammatory Activity. Journal of natural products, 2019, 82, 2818-2827 |
1552597 | CIF | C32 H38 O10 | P 1 | 7.43158; 12.64114; 16.6155 68.6576; 84.8142; 83.4169 | 1442.29 | Solipeta, Divya Reddy; Bandi, Siva; Vemulapalli, Sahithya Phani Babu; Pallavi, Preethi M. C.; Vemireddy, Sravanthi; Balasubramania, Sridhar; Mahabalarao, Sampath Kumar H.; Katragadda, Suresh Babu Secophragmalin-Type Limonoids from <i>Trichilia connaroides</i>: Isolation, Semisynthesis, and Their Cytotoxic Activities. Journal of natural products, 2019, 82, 2731-2743 |
1552682 | CIF | C19 H20 N2 | P 1 | 6.5325; 7.8576; 8.6225 109.428; 94.781; 113.321 | 371.29 | Wong, Soon-Kit; Wong, Suet-Pick; Sim, Kae-Shin; Lim, Siew-Huah; Low, Yun-Yee; Kam, Toh-Seok A Cytotoxic Indole Characterized by Incorporation of a Unique Carbon-Nitrogen Skeleton and Two Pentacyclic Corynanthean Alkaloids Incorporating a Substituted Tetrahydrofuranone Ring from <i>Kopsia arborea</i>. Journal of natural products, 2019, 82, 1902-1907 |
1552705 | CIF | C31 H51 N O2 | P 1 | 6.4002; 7.3244; 15.8163 76.713; 85.687; 65.123 | 654.44 | Kazakova, Oxana B.; Khusnutdinova, Elmira F.; Petrova, Anastasiya V.; Yamansarov, Emil Yu; Lobov, Alexander N.; Fedorova, Alexandra A.; Suponitsky, Kyrill Yu Diastereoselective Synthesis of Triterpenoid 1,2,4-Trioxolanes by Griesbaum Co-ozonolysis. Journal of natural products, 2019, 82, 2550-2558 |
1552712 | CIF | C20 H20 O5 | P 1 | 7.3973; 11.0738; 12.082 69.81; 77.629; 77.212 | 895.52 | Paguigan, Noemi D.; Rivera-Chávez, José; Stempin, Justin J.; Augustinović, Mario; Noras, Aleksandra I.; Raja, Huzefa A.; Todd, Daniel A.; Triplett, Kathleen D.; Day, Cynthia; Figueroa, Mario; Hall, Pamela R.; Cech, Nadja B.; Oberlies, Nicholas H. Prenylated Diresorcinols Inhibit Bacterial Quorum Sensing. Journal of natural products, 2019, 82, 550-558 |
1552944 | CIF | C30 H45 N4 O2 | P 1 | 6.0631; 9.7279; 11.3631 89.483; 87.316; 77.462 | 653.51 | Fan, Chun-Lin; Zhang, Yu-Bo; Chen, Ye; Xie, Pei; Wang, Guo-Cai; Tian, Hai-Yan; Li, Yao-Lan; Huang, Xiao-Jun; Zhang, Xiao-Qi; Li, Zhi-Yong; Liu, Jun-Shan; Ye, Wen-Cai; Chen, Wei-Min Alopecuroides A‒E, Matrine-Type Alkaloid Dimers from the Aerial Parts of Sophora alopecuroides Journal of Natural Products, 2019 |
1552945 | CIF | C31 H48 N4 O3 | P 1 | 8.4347; 8.6934; 9.8006 101.982; 95.217; 96.552 | 693.518 | Fan, Chun-Lin; Zhang, Yu-Bo; Chen, Ye; Xie, Pei; Wang, Guo-Cai; Tian, Hai-Yan; Li, Yao-Lan; Huang, Xiao-Jun; Zhang, Xiao-Qi; Li, Zhi-Yong; Liu, Jun-Shan; Ye, Wen-Cai; Chen, Wei-Min Alopecuroides A‒E, Matrine-Type Alkaloid Dimers from the Aerial Parts of Sophora alopecuroides Journal of Natural Products, 2019 |
1552972 | CIF | C17 H21 B Br O P | P 1 | 6.4951; 9.549; 15.501 81.333; 86.707; 74.351 | 915 | Li, Chun; Bian, Qing-Long; Xu, Sheng; Duan, Wei-Liang Palladium-catalyzed 1,4-addition of secondary alkylphenylphosphines to α,β-unsaturated carbonyl compounds for the synthesis of phosphorus- and carbon-stereogenic compounds Org. Chem. Front., 2014, 1, 541 |
1553294 | CIF | C45 H63 N O7 | P 1 | 6.3429; 7.2295; 22.835 86.897; 87.866; 68.166 | 970.42 | Li, Jin-Long; Wu, Lei; Wu, Jian; Feng, Hong-Xuan; Wang, Hong-Min; Fu, Yan; Zhang, Ru-Jun; Zhang, Hai-Yan; Zhao, Wei-Min Caffeoyl Triterpenoid Esters as Potential Anti-ischemic Stroke Agents from Celastrus orbiculatus. Journal of natural products, 2016, 79, 2774-2779 |
1553299 | CIF | C14 H22 O6 | P 1 | 6.3082; 7.5108; 8.11 88.911; 85.044; 77.888 | 374.29 | Liu, Shuai; Dai, Haofu; Makhloufi, Gamall; Heering, Christian; Janiak, Christoph; Hartmann, Rudolf; Mándi, Attila; Kurtán, Tibor; Müller, Werner E G; Kassack, Matthias U.; Lin, Wenhan; Liu, Zhen; Proksch, Peter Cytotoxic 14-Membered Macrolides from a Mangrove-Derived Endophytic Fungus, Pestalotiopsis microspora. Journal of natural products, 2016, 79, 2332-2340 |
1553335 | CIF | C13 H15 Cl O7 | P 1 | 5.0238; 5.5679; 12.8812 99.395; 94.679; 105.645 | 339.31 | Cai, Runlin; Wu, Yingnan; Chen, Senhua; Cui, Hui; Liu, Zhaoming; Li, Chunyuan; She, Zhigang Peniisocoumarins A-J: Isocoumarins from Penicillium commune QQF-3, an Endophytic Fungus of the Mangrove Plant Kandelia candel. Journal of natural products, 2018, 81, 1376-1383 |
1553342 | CIF | C17 H22 O9 | P 1 | 4.9; 12.5; 14.55 86.4; 88.07; 80.31 | 876.5 | Deans, Bianca J.; Kilah, Nathan L.; Jordan, Gregory J.; Bissember, Alex C.; Smith, Jason A. Arbutin Derivatives Isolated from Ancient Proteaceae: Potential Phytochemical Markers Present in Bellendena, Cenarrhenes, and Persoonia Genera. Journal of natural products, 2018, 81, 1241-1251 |
1553348 | CIF | C26 H34 O8 | P 1 | 6.5706; 7.0972; 13.8873 103.479; 90.068; 105.91 | 604.17 | Qi, Changxing; Liu, Mengting; Zhou, Qun; Gao, Weixi; Chen, Chunmei; Lai, Yongji; Hu, Zhengxi; Xue, Yongbo; Zhang, Jinwen; Li, Dongyan; Li, Xiao-Nian; Zhang, Qing; Wang, Jianping; Zhu, Hucheng; Zhang, Yonghui BACE1 Inhibitory Meroterpenoids from Aspergillus terreus. Journal of natural products, 2018, 81, 1937-1945 |
1553360 | CIF | C24 H39 N O7 | P 1 | 8.054; 12.548; 14.0945 115.86; 94.702; 102.435 | 1226.37 | Wang, Wenjing; Gong, Jiaojiao; Liu, Xiaorui; Dai, Chong; Wang, Yanyan; Li, Xiao-Nian; Wang, Jianping; Luo, Zengwei; Zhou, Yuan; Xue, Yongbo; Zhu, Hucheng; Chen, Chunmei; Zhang, Yonghui Cytochalasans Produced by the Coculture of Aspergillus flavipes and Chaetomium globosum. Journal of natural products, 2018, 81, 1578-1587 |
1553376 | CIF | C21 H32 O3 | P 1 | 6.2785; 10.5538; 14.393 100.197; 100.924; 91.722 | 919.64 | Zhang, Shasha; Wang, Xia; Hao, Jin; Li, Dangdang; Csuk, René; Li, Shengkun Expediently Scalable Synthesis and Antifungal Exploration of (+)-Yahazunol and Related Meroterpenoids. Journal of natural products, 2018, 81, 2010-2017 |
1553750 | CIF | C26 H31 N3 O6 | P 1 | 9.0047; 9.2247; 9.4826 109.875; 108.593; 107.103 | 626.45 | Guo, Jing; Lin, Zi-Hui; Chen, Kai-Bin; Xie, Ying; Chan, Albert S. C.; Weng, Jiang; Lu, Gui Asymmetric amination of 2-substituted indolin-3-ones catalyzed by natural cinchona alkaloids Organic Chemistry Frontiers, 2017, 4, 1400 |
1553817 | CIF | C20 H16 F3 N O3 S | P 1 | 8.5679; 12.3701; 18.181 83.843; 89.595; 80.871 | 1891.4 | De Nisi, A.; Sierra, S.; Ferrara, M.; Monari, M.; Bandini, M. TBAF catalyzed one-pot synthesis of allenyl-indoles Organic Chemistry Frontiers, 2017, 4, 1849 |
1553852 | CIF | C88 H122 N2 O4 S2 | P 1 | 8.9041; 14.0916; 16.2768 104.121; 91.824; 94.954 | 1970.23 | Zhang, Yuehong; Wang, Chiming; Chen, Xin; Pan, Houhe; Qi, Dongdong; Wang, Kang; Jiang, Jianzhuang Novel, linear oligoisoindole compounds with a conjugated electronic structure Organic Chemistry Frontiers, 2017, 4, 2364 |
1553941 | CIF | C23 H22 N2 O7 | P 1 | 9.297; 11.515; 11.957 61.974; 80.333; 67.602 | 1044.6 | Han, Jianxin; Niu, Sheng-Tong; Liu, Yushuang; Gan, Lishe; Wang, Tianfu; Lu, Chong-Dao; Yuan, Tao Robustanoids A and B, two novel pyrrolo[2,3-b]indole alkaloids from Coffea canephora: isolation and total synthesis Organic Chemistry Frontiers, 2018, 5, 586 |
1554165 | CIF | C37 H48 N O P | P 1 | 10.369; 10.511; 16.499 94.563; 96.525; 114.894 | 1604.3 | Serin, Spencer C.; Dake, Gregory R.; Gates, Derek P. Addition-Isomerization Polymerization of Chiral Phosphaalkenes: Observation of Styrene‒Phosphaalkene Linkages in a Random Copolymer Macromolecules, 2016, 49, 4067 |
1554236 | CIF | C25 H20 S | P 1 | 8.886; 10.971; 11.261 64.477; 78.704; 77.452 | 960.5 | Wang, Can; Yu, Yun; Chai, Zhaofei; He, Fangdi; Wu, Chaozheng; Gong, Yanbin; Han, Mengmeng; Li, Qianqian; Li, Zhen Recyclable mechanoluminescent luminogen: different polymorphs, different self-assembly effects of the thiophene moiety and recovered molecular packing via simple thermal-treatment Materials Chemistry Frontiers, 2019, 3, 32 |
1554254 | CIF | C28 H36 O8 | P 1 | 13.986; 14.019; 28.0285 98.119; 91.053; 90.157 | 5439.5 | Yin, Guo-Ping; Wu, Ya-Rong; Han, Chao; Wang, Xiao-Bing; Gao, Hong-Liang; Yin, Yong; Kong, Ling-Yi; Yang, Ming-Hua Asperones A‒E, five dimeric polyketides with new carbon skeletons from the fungus Aspergillus sp. AWG 1‒15 Organic Chemistry Frontiers, 2018, 5, 2432 |
1554273 | CIF | C77.37 H93.1 N4 O24 | P 1 | 10.54064; 14.6009; 14.9312 62.0192; 84.9082; 68.8864 | 1884.1 | Li, Wan-Shan; Yang, Yang; Liu, Jun-Jun; Shen, Li; Shi, Zhi; Wu, Jun Scaffold diversity-oriented synthesis of limonoid dimers: discovery of an axially chiral agent within vivoanti-breast cancer activity Organic Chemistry Frontiers, 2018, 5, 1079 |
1554324 | CIF | C31 H56 F6 Mg N4 O14 S2 | P 1 | 9.2007; 9.2791; 14.237 97.598; 91.193; 97.349 | 1194.02 | Zhang, Xiying; Liu, Xiaohua; Zhang, Jianlin; Zhang, Dong; Lin, Lili; Feng, Xiaoming Enantioselective [3 + 2] cycloaddition and rearrangement of thiazolium salts to synthesize thiazole and 1,4-thiazine derivatives Organic Chemistry Frontiers, 2018, 5, 2126 |
1554425 | CIF | C18 H16 Br F O2 | P 1 | 6.6841; 8.7074; 14.4482 87.391; 81.591; 78.532 | 815.14 | Cao, Zhong-Yan; Wang, Wenmin; Liao, Kui; Wang, Xiaoming; Zhou, Jian; Ma, Jing Catalytic enantioselective synthesis of cyclopropanes featuring vicinal all-carbon quaternary stereocenters with a CH2F group; study of the influence of C‒F⋯H‒N interactions on reactivity Organic Chemistry Frontiers, 2018, 5, 2960 |
1554500 | CIF | C27 H22 N O2 P | P 1 | 6.0253; 9.0011; 10.3679 75.005; 76.437; 89.09 | 527.4 | Zhang, Dong-Liang; Li, Cheng-Kun; Zeng, Run-Sheng; Shoberu, Adedamola; Zou, Jian-Ping Manganese(iii)-mediated selective phosphorylation of enamides: direct synthesis of β-phosphoryl enamides Organic Chemistry Frontiers, 2019, 6, 236 |
1554573 | CIF | C10 H13 N O3 | P 1 | 6.9308; 6.9507; 11.8464 84.194; 79.023; 64.094 | 503.84 | Yang, Wu-Lin; Sun, Zhong-Tao; Zhang, Jian; Li, Zhong; Deng, Wei-Ping Enantioselective synthesis of 3-amino-hydrobenzofuran-2,5-diones via Cu(i)-catalyzed intramolecular conjugate addition of imino esters Organic Chemistry Frontiers, 2019, 6, 579 |
1554676 | CIF | C30 H22 N2 O2 S | P 1 | 12.1382; 12.8179; 15.1854 85.684; 78.373; 89.276 | 2307.59 | Chen, Yitong; Xu, Chao; Xu, Bingjia; Mao, Zhu; Li, Jian-An; Yang, Zhan; Peethani, Naga Raju; Liu, Cong; Shi, Guang; Gu, Feng Long; Zhang, Yi; Chi, Zhenguo Chirality-activated mechanoluminescence from aggregation-induced emission enantiomers with high contrast mechanochromism and force-induced delayed fluorescence Materials Chemistry Frontiers, 2019, 3, 1800 |
1554678 | CIF | C30 H22 N2 O2 S | P 1 | 12.135; 12.8327; 15.1864 85.785; 78.371; 89.345 | 2310.08 | Chen, Yitong; Xu, Chao; Xu, Bingjia; Mao, Zhu; Li, Jian-An; Yang, Zhan; Peethani, Naga Raju; Liu, Cong; Shi, Guang; Gu, Feng Long; Zhang, Yi; Chi, Zhenguo Chirality-activated mechanoluminescence from aggregation-induced emission enantiomers with high contrast mechanochromism and force-induced delayed fluorescence Materials Chemistry Frontiers, 2019, 3, 1800 |
1554735 | CIF | C32 H33 Cl3 N4 Ni O4 | P 1 | 9.3743; 13.379; 14.9327 81.008; 89.658; 80.276 | 1822.85 | Larionov, Vladimir A.; Stoletova, Nadezhda V.; Kovalev, Vladislav I.; Smol'yakov, Alexander F.; Savel'yeva, Tat'yana F.; Maleev, Victor I. A general synthesis of unnatural α-amino acids by iron-catalysed olefin‒olefin coupling via generated radicals Organic Chemistry Frontiers, 2019, 6, 1094 |
1554885 | CIF | C20 H20 Br2 Cl2 N2 O4 | P 1 | 5.0746; 14.828; 16.699 65.191; 89.579; 80.838 | 1123.5 | Shemet, Andrej; Sarlah, David; Carreira, Erick M. Stereochemical studies of the opening of chloro vinyl epoxides: cyclic chloronium ions as intermediates. Organic letters, 2015, 17, 1878-1881 |
1555006 | CIF | C30 H35 N O4 | P 1 | 9.7073; 10.168; 14.0374 85.597; 85.998; 82.306 | 1366.53 | Davies, Stephen G.; Fletcher, Ai M.; Frost, Aileen B.; Roberts, Paul M.; Thomson, James E. Asymmetric Synthesis of Substituted anti-β-Fluorophenylalanines. Organic letters, 2015, 17, 2254-2257 |
1555007 | CIF | C28 H31 F2 N O2 | P 1 | 10.4764; 10.6867; 12.3768 85.757; 70.552; 69.477 | 1222.26 | Davies, Stephen G.; Fletcher, Ai M.; Frost, Aileen B.; Roberts, Paul M.; Thomson, James E. Asymmetric Synthesis of Substituted anti-β-Fluorophenylalanines. Organic letters, 2015, 17, 2254-2257 |
1555042 | CIF | C33 H38 N O5 | P 1 | 9.1302; 9.1578; 10.226 108.986; 98.417; 114.037 | 698.83 | Freeman, Jared L.; Brimble, Margaret A.; Furkert, Daniel P. A chiral auxiliary-based synthesis of the C5‒C17 trans-decalin framework of anthracimycin Organic Chemistry Frontiers, 2019, 6, 2954 |
1555113 | CIF | C33 H25 Cl N2 O5 | P 1 | 10.596; 11.6796; 12.6988 69.855; 70.549; 88.791 | 1383.42 | Wang, Zhen-Hua; Lei, Chuan-Wen; Zhang, Xia-Yan; You, Yong; Zhao, Jian-Qiang; Yuan, Wei-Cheng Asymmetric domino 1,6-addition/annulation reaction of 3-cyano-4-alkenyl-2H-chromen-2-ones with isatin-derived MBH carbonates: enantioselective synthesis of 3,3′-cyclopentenylspirooxindoles bearing 2H-chromen-2-ones Organic Chemistry Frontiers, 2019, 6, 3342 |
1555114 | CIF | C18 H23 N O5 S | P 1 | 8.6291; 9.4332; 12.4474 82.659; 70.506; 68.236 | 887.04 | Hsueh, Nathanael; Clarkson, Guy J.; Shipman, Michael Generation and Ring Opening of Aziridines in Telescoped Continuous Flow Processes. Organic letters, 2015, 17, 3632-3635 |
1555129 | CIF | C7.5 H15 O2 | P 1 | 7.0302; 7.6119; 7.7844 94.191; 109.731; 97.56 | 385.61 | Song, Yin-Ping; Miao, Feng-Ping; Yin, Xiu-Li; Ji, Nai-Yun Nitrogenous cyclonerane sesquiterpenes from an algicolous strain of Trichoderma asperellum Organic Chemistry Frontiers, 2019, 6, 3698 |
1555277 | CIF | C32.33333 H57.66667 N6 O12.66667 | P 1 | 15.4725; 16.0538; 16.749 107.8; 106.461; 106.157 | 3482.3 | Ganesh Kumar, Mothukuri; Gopi, Hosahudya N. γ- and β-Peptide Foldamers from Common Multifaceted Building Blocks: Synthesis and Structural Characterization. Organic letters, 2015, 17, 4738-4741 |
1555328 | CIF | C35 H30 Br F N4 O4 | P 1 | 8.4125; 9.7659; 11.5692 108.577; 95.876; 110.228 | 820.9 | Bao, Xiaoze; Wang, Baomin; Cui, Longchen; Zhu, Guodong; He, Yuli; Qu, Jingping; Song, Yuming An Organocatalytic Asymmetric Friedel-Crafts Addition/Fluorination Sequence: Construction of Oxindole-Pyrazolone Conjugates Bearing Vicinal Tetrasubstituted Stereocenters. Organic letters, 2015, 17, 5168-5171 |
1555545 | CIF | C24 H25 N O4 | P 1 | 12.7971; 12.8656; 14.0933 88.968; 86.108; 66.582 | 2124.21 | Ruchti, Jonathan; Carreira, Erick M. Rh-Catalyzed Stereospecific Synthesis of Allenes from Propargylic Benzoates and Arylboronic Acids. Organic letters, 2016, 18, 2174-2176 |
1555571 | CIF | C24 H35 N O5 | P 1 | 5.9846; 7.913; 12.691 99.814; 95.953; 107.509 | 557 | Nagaraju, Karre; Chegondi, Rambabu; Chandrasekhar, Srivari Expanding Diversity without Protecting Groups: (+)-Sclareolide to Indolosesquiterpene Alkaloid Mycoleptodiscin A and Analogues. Organic letters, 2016, 18, 2684-2687 |
1555592 | CIF | C66 H66 O12 P2 | P 1 | 11.2057; 15.2204; 18.506 71.165; 81.596; 89.993 | 2951.5 | Durantie, Estelle; Huwiler, Samuel; Leroux, Jean-Christophe; Castagner, Bastien A Chiral Phosphoramidite Reagent for the Synthesis of Inositol Phosphates. Organic letters, 2016, 18, 3162-3165 |
1555681 | CIF | C27.5 H23.5 Br Cl1.5 N2 O8 | P 1 | 9.4486; 11.0765; 16.057 73.497; 87.912; 72.63 | 1535.63 | Bender, Trandon A.; Dabrowski, Jennifer A.; Zhong, Hongyu; Gagné, Michel R Diastereoselective B(C6F5)3-Catalyzed Reductive Carbocyclization of Unsaturated Carbohydrates. Organic letters, 2016, 18, 4120-4123 |
1555793 | CIF | C30 H22 Br2 N2 O4 S2 | P 1 | 7.9207; 9.0758; 11.1924 80.79; 71.85; 65.087 | 693.02 | Seo, Boram; Kim, Ya Gob; Lee, Phil Ho Synthesis of Isothiazole via the Rhodium-Catalyzed Transannulation of 1,2,3-Thiadiazoles with Nitriles. Organic letters, 2016, 18, 5050-5053 |
1555826 | CIF | C18 H14 O3 | P 1 | 7.6607; 9.2315; 11.127 72.019; 79.887; 74.428 | 717.29 | Zhu, Gongming; Bao, Guangjun; Li, Yiping; Yang, Junxian; Sun, Wangsheng; Li, Jing; Hong, Liang; Wang, Rui Chiral Phosphoric Acid Catalyzed Asymmetric Oxidative Dearomatization of Naphthols with Quinones. Organic letters, 2016, 18, 5288-5291 |
1555870 | CIF | C20 H21 N O2 | P 1 | 7.0663; 8.3624; 8.9048 115.442; 109.848; 92.591 | 435.48 | Guo, Jing; Lin, Lili; Liu, Yangbin; Li, Xiangqiang; Liu, Xiaohua; Feng, Xiaoming Nickel(II)-Catalyzed Enantioselective α-Vinylation of β-Keto Amides/Esters with Hypervalent Iodine Salts. Organic letters, 2016, 18, 5540-5543 |
1556027 | CIF | C51 H37 N5 O S Zn | P 1 | 10.6689; 10.8762; 18.2817 83.457; 84.152; 77.519 | 2051.2 | Gholami, Hadi; Zhang, Jun; Anyika, Mercy; Borhan, Babak Absolute Stereochemical Determination of Asymmetric Sulfoxides via Central to Axial Induction of Chirality. Organic letters, 2017, 19, 1722-1725 |
1556114 | CIF | C18 H20 Cl N O | P 1 | 9.0186; 10.1685; 10.338 106.26; 92.413; 114.734 | 812.73 | Tanaka, Ken; Wada, Azusa; Noguchi, Keiichi Rhodium-catalyzed chemo-, regio-, and enantioselective [2 + 2 + 2] cycloaddition of alkynes with isocyanates. Organic letters, 2005, 7, 4737-4739 |
1556140 | CIF | C22 H21 Cl O4 | P 1 | 5.7264; 7.5889; 21.5174 91.997; 94.434; 90.306 | 931.69 | Bastida, David; Liu, Yankai; Tian, Xu; Escudero-Adán, Eduardo; Melchiorre, Paolo Asymmetric vinylogous aldol reaction via H-bond-directing dienamine catalysis. Organic letters, 2013, 15, 220-223 |
1556221 | CIF | C32 H37 Br O5 | P 1 | 5.9898; 9.7098; 12.2465 90.307; 91.544; 99.152 | 702.9 | Ma, Shuang-Gang; Gao, Rong-Mei; Li, Yu-Huan; Jiang, Jian-Dong; Gong, Ning-Bo; Li, Li; Lü, Yang; Tang, Wen-Zhao; Liu, Yun-Bao; Qu, Jing; Lü, Hai-Ning; Li, Yong; Yu, Shi-Shan Antiviral spirooliganones A and B with unprecedented skeletons from the roots of Illicium oligandrum. Organic letters, 2013, 15, 4450-4453 |
1556228 | CIF | C24 H31 N O3 S2 | P 1 | 8.2523; 9.66; 15.0901 79.648; 84.413; 82.507 | 1169.88 | Fernández de la Pradilla, Roberto; Simal, Carmen; Bates, Robert H.; Viso, Alma; Infantes, Lourdes Sulfoxide-directed enantioselective synthesis of functionalized tetrahydropyridines. Organic letters, 2013, 15, 4936-4939 |
1556327 | CIF | C30 H56 Cl2 N4 O2 Pd | P 1 | 8.1693; 9.1162; 22.9935 93.592; 91.806; 89.939 | 1708.2 | Peral, Daniel; Gómez-Villarraga, Fernando; Sala, Xavier; Pons, Josefina; Carles Bayón, J.; Ros, Josep; Guerrero, Miguel; Vendier, Laure; Lecante, Pierre; García-Antón, Jordi; Philippot, Karine Palladium catalytic systems with hybrid pyrazole ligands in C‒C coupling reactions. Nanoparticles versus molecular complexes Catal. Sci. Technol., 2013, 3, 475 |
1556334 | CIF | C85 H86 B Cl4 F4 O6 P6 Rh3 | P 1 | 13.136; 13.405; 14.779 85.58; 68.44; 68.06 | 2239.6 | Preetz, Angelika; Kohrt, Christina; Meißner, Antje; Wei, Siping; Drexler, Hans-Joachim; Buschmann, Helmut; Heller, Detlef Halide bridged trinuclear rhodium complexes and their inhibiting influence on catalysis Catal. Sci. Technol., 2013, 3, 462 |
1556339 | CIF | C36 H86 B F4 O2 P6 Rh3 | P 1 | 12.416; 12.444; 18.186 95.81; 94.37; 111.98 | 2572.3 | Preetz, Angelika; Kohrt, Christina; Meißner, Antje; Wei, Siping; Drexler, Hans-Joachim; Buschmann, Helmut; Heller, Detlef Halide bridged trinuclear rhodium complexes and their inhibiting influence on catalysis Catal. Sci. Technol., 2013, 3, 462 |
1556340 | CIF | C37 H86 B Cl4 F4 P6 Rh3 | P 1 | 9.6676; 12.005; 12.658 109.83; 94.19; 90.56 | 1377.3 | Preetz, Angelika; Kohrt, Christina; Meißner, Antje; Wei, Siping; Drexler, Hans-Joachim; Buschmann, Helmut; Heller, Detlef Halide bridged trinuclear rhodium complexes and their inhibiting influence on catalysis Catal. Sci. Technol., 2013, 3, 462 |
1556871 | CIF | C59 H27 F20 Fe N5 | P 1 | 10.5317; 14.347; 17.434 76.71; 80.147; 84.826 | 2522.3 | Wang, Hai-Xu; Wan, Qingyun; Low, Kam-Hung; Zhou, Cong-Ying; Huang, Jie-Sheng; Zhang, Jun-Long; Che, Chi-Ming Stable group 8 metal porphyrin mono- and bis(dialkylcarbene) complexes: synthesis, characterization, and catalytic activity. Chemical science, 2020, 11, 2243-2259 |
1557030 | CIF | C50 H22 Al2 F74 Mg N6 O8 | P 1 | 14.3953; 18.2606; 25.8315 73.784; 74.37; 66.821 | 5895.1 | Schorpp, Marcel; Krossing, Ingo Soft interactions with hard Lewis acids: generation of mono- and dicationic alkaline-earth metal arene-complexes by direct oxidation. Chemical science, 2020, 11, 2068-2076 |
1557185 | CIF | C25 H23 F4 N5 O5 | P 1 | 10.1492; 10.1392; 25.2626 96.515; 96.515; 107.35 | 2435.42 | Yang, Yaxi; Zhang, Rukang; Li, Zhaojun; Mei, Lianghe; Wan, Shili; Ding, Hong; Chen, Zhifeng; Xing, Jing; Feng, Huijin; Han, Jie; Jiang, Hualiang; Zheng, Mingyue; Luo, Cheng; Zhou, Bing Discovery of Highly Potent, Selective, and Orally Efficacious p300/CBP Histone Acetyltransferases Inhibitors. Journal of medicinal chemistry, 2020 |
1557202 | CIF | C21 H26 O5 | P 1 | 6.3062; 7.6848; 9.7183 87.904; 80.198; 87.694 | 463.505 | Wang, Rong; Fan, Run-Zhu; Ni, Fu-Qiang; Sang, Jun; Xie, Xing-Lin; Luo, Si-Yuan; Tang, Gui-Hua; Yin, Sheng 19-nor-, 20-nor-, and tetranor-Halimane-Type Furanoditerpenoids from Croton crassifolius Journal of Natural Products, 2020 |
1557260 | CIF | Cr H9 N12 | P 1 | 7.661; 10.19; 5.807 93.58; 101.37; 81.3 | 439.1 | Dossing, Anders; Engberg, Pernille; Hazell, Rita Crystal Structures and Nitrosation Reactions of Triamminetriazido Complexes of Chromium(III) Acta Chemica Scandinavica, 1997, 51, 849-854 |
1557272 | CIF | C35 H40 O12 | P 1 | 8.505; 9.1711; 10.7701 100.159; 99.818; 90.932 | 813.86 | Fu, Yifan; Zhao, Weimin Polyesterified Sesquiterpenoids from the Seeds of <i>Celastrus paniculatus</i> as Lifespan-Extending Agents for the Nematode <i>Caenorhabditis elegans</i>. Journal of natural products, 2020, 83, 505-515 |
1557332 | CIF | C112.95 H130.95 Cl15.56 O28 | P 1 | 14.334; 15.534; 16.891 69.752; 70.947; 76.995 | 3308.6 | Payne, Daniel T.; Webre, Whitney A.; Gobeze, Habtom B.; Seetharaman, Sairaman; Matsushita, Yoshitaka; Karr, Paul A.; Chahal, Mandeep K.; Labuta, Jan; Jevasuwan, Wipakorn; Fukata, Naoki; Fossey, John S.; Ariga, Katsuhiko; D'Souza, Francis; Hill, Jonathan P. Nanomolecular singlet oxygen photosensitizers based on hemiquinonoid-resorcinarenes, the fuchsonarenes. Chemical science, 2020, 11, 2614-2620 |
1557371 | CIF | C27 H19 N O3 | P 1 | 7.1378; 9.8466; 14.7942 88.9786; 79.0044; 74.6213 | 983.56 | Sasaki, Yui; Kojima, Soya; Hamedpour, Vahid; Kubota, Riku; Takizawa, Shin-ya; Yoshikawa, Isao; Houjou, Hirohiko; Kubo, Yuji; Minami, Tsuyoshi Accurate chiral pattern recognition for amines from just a single chemosensor Chemical Science, 2020, 11, 3790-3796 |
1557467 | CIF | C61 H79 Cl N2 Pd | P 1 | 10.9521; 12.1033; 12.578 115.914; 92.683; 110.251 | 1367.6 | Dai, Shengyu; Li, Shuaikang; Xu, Guoyong; Wu, Cheng; Liao, Yudan; Guo, Lihua Flexible cycloalkyl substituents in insertion polymerization with α-diimine nickel and palladium species Polymer Chemistry, 2020, 11, 1393-1400 |
1557726 | CIF | C10 H17 Cl4 N2 O Ru S3 | P 1 | 8.0381; 8.1691; 8.3951 85.2736; 71.5044; 61.7748 | 459.11 | Huffman, Samantha E.; Yawson, Gideon K.; Fisher, Samuel S.; Bothwell, Paige J.; Platt, David C.; Jones, Marjorie A.; Hamaker, Christopher G.; Webb, Michael I. Ruthenium(iii) complexes containing thiazole-based ligands that modulate amyloid-β aggregation. Metallomics : integrated biometal science, 2020, 12, 491-503 |
1557888 | CIF | C16 H19 Cl O6 | P 1 | 8.6811; 9.5462; 10.951 69.576; 84.021; 68.822 | 792.79 | Zhou, Jia; Gao, Ying; Chang, Jin-Ling; Yu, Heng-Yi; Chen, Juan; Zhou, Ming; Meng, Xiang-Gao; Ruan, Han-Li Resorcylic Acid Lactones from an Ilyonectria sp. Journal of Natural Products, 2020 |
1558175 | CIF | C19 H23 N3 O2 | P 1 | 6.0571; 10.1647; 14.3715 103.628; 98.272; 101.112 | 827.01 | Pagire, Santosh K.; Kumagai, Naoya; Shibasaki, Masakatsu Introduction of a 7-aza-6-MeO-indoline auxiliary in Lewis-acid/photoredox cooperative catalysis: highly enantioselective aminomethylation of α,β-unsaturated amides Chemical Science, 2020, 11, 5168-5174 |
1558329 | CIF HKL Paper | C23 H34 Cl3 N O12 | P 1 | 5.5734; 9.2537; 14.2547 91.995; 99.103; 95.567 | 721.56 | Amaro Hernández, Aldo Guillermo; Rodríguez Tzompantzi, Tomasa; Dávila García, Álvaro; Meza-León, Rosa Luisa; Bernès, Sylvain Ethyl (3<i>S</i>)-3-[(3a<i>R</i>,5<i>R</i>,6<i>S</i>,6a<i>R</i>)-6-hydroxy-2,2-dimethyltetrahydrofuro[4,5-<i>d</i>][1,3]dioxol-5-yl]-3-{(3<i>S</i>)-3-[(3a<i>R</i>,5<i>R</i>,6<i>S</i>,6a<i>R</i>)-6-hydroxy-2,2-dimethyltetrahydrofuro[4,5-<i>d</i>][1,3]dioxol-5-yl]-5-oxoisoxazolidin-2-yl}propanoate chloroform monosolvate IUCrData, 2020, 5, x200788 |
1558411 | CIF | C16 H19 N O3 | P 1 | 6.398; 14.807; 16.109 75.33; 82.974; 81.03 | 1452.8 | de Diego, Heidi Lopez Crystal Structure of (S)-1-Phenylethylammonium (R)-Mandelate and a Comparison of Diastereomeric Mandelate Salts of 1-Phenylethylamine Acta Chemica Scandinavica, 1994, 48, 306-311 |
1558661 | CIF | C23 H34 O4 | P 1 | 10.715; 11.6367; 14.6771 110.288; 110.241; 91.134 | 1590.1 | Chen, Ming; Wang, Wen-Jing; Li, Ni-Ping; Zeng, Hu-Hu; Guo, Hong; Jiang, Ren-Wang; Wang, Lei; Ye, Wen-Cai Myrcaulones A‒C, Unusual Rearranged Triketone‒Terpene Adducts from Myrciaria cauliflora Journal of Natural Products, 2020 |
1558670 | CIF | C20 H33 F2 N O4 | P 1 | 8.6196; 10.2451; 12.2006 106.432; 94.759; 90.868 | 1029.01 | Hill, David R.; Abrahamson, Michael J.; Lukin, Kirill A.; Towne, Timothy B.; Engstrom, Kenneth M.; Reddy, Rajarathnam E.; Kielbus, Angelica B.; Pelc, Matthew J.; Mei, Jianzhang; Nere, Nandkishor K.; Chen, Shuang; Henry, Rodger; Chemburkar, Sanjay; Ding, Chen; Zhang, Hongqiang; Cink, Russell D. Development of a Large-Scale Route to Glecaprevir: Synthesis of the Side Chain and Final Assembly Organic Process Research & Development, 2020 |
1558671 | CIF | C20 H33 F2 N O4 | P 1 | 9.4358; 10.0861; 11.3101 94.68; 91.031; 97.524 | 1063.11 | Hill, David R.; Abrahamson, Michael J.; Lukin, Kirill A.; Towne, Timothy B.; Engstrom, Kenneth M.; Reddy, Rajarathnam E.; Kielbus, Angelica B.; Pelc, Matthew J.; Mei, Jianzhang; Nere, Nandkishor K.; Chen, Shuang; Henry, Rodger; Chemburkar, Sanjay; Ding, Chen; Zhang, Hongqiang; Cink, Russell D. Development of a Large-Scale Route to Glecaprevir: Synthesis of the Side Chain and Final Assembly Organic Process Research & Development, 2020 |
1558672 | CIF | C20 H33 F2 N O4 | P 1 | 8.6295; 10.2499; 12.1993 106.366; 94.675; 90.873 | 1031.06 | Hill, David R.; Abrahamson, Michael J.; Lukin, Kirill A.; Towne, Timothy B.; Engstrom, Kenneth M.; Reddy, Rajarathnam E.; Kielbus, Angelica B.; Pelc, Matthew J.; Mei, Jianzhang; Nere, Nandkishor K.; Chen, Shuang; Henry, Rodger; Chemburkar, Sanjay; Ding, Chen; Zhang, Hongqiang; Cink, Russell D. Development of a Large-Scale Route to Glecaprevir: Synthesis of the Side Chain and Final Assembly Organic Process Research & Development, 2020 |
1558733 | CIF | C70 H55 Au3 Cl6 Fe3 N3 P3 | P 1 | 9.8526; 10.9313; 18.774 92.519; 103.594; 95.61 | 1951.25 | Straube, Axel A.; Coburger, Peter; Duetsch, Luis; Hey-Hawkins, Evamarie Triple the fun: Tris(ferrocenyl)arene-based gold(I) complexes for redox-switchable catalysis Chemical Science, 2020 |
1559131 | CIF | C15 H22 O3 | P 1 | 8.6358; 9.3834; 9.8633 74.596; 86.938; 68.597 | 716.6 | Zhang, Jing-Fang; Zhong, Wan-Chao; Li, Yan-Cheng; Song, Yun-Qing; Xia, Gui-Yang; Tian, Gui-Hua; Ge, Guang-Bo; Lin, Sheng Bioactivity-Guided Discovery of Human Carboxylesterase Inhibitors from the Roots of Paeonia lactiflora Journal of Natural Products, 2020 |
1559262 | CIF | C33 H50 O9 | P 1 | 8.0071; 10.1293; 20.8919 84.188; 80.126; 89.579 | 1660.7 | Olivon, Florent; Retailleau, Pascal; Desrat, Sandy; Touboul, David; Roussi, Fanny; Apel, Cécile; Litaudon, Marc Isolation of Picrotoxanes from <i>Austrobuxus carunculatus</i> Using Taxonomy-Based Molecular Networking. Journal of natural products, 2020, 83, 3069-3079 |
1559263 | CIF | C15 H18 O6 | P 1 | 6.9816; 7.0672; 7.8911 81.9415; 73.77; 62.844 | 332.59 | Olivon, Florent; Retailleau, Pascal; Desrat, Sandy; Touboul, David; Roussi, Fanny; Apel, Cécile; Litaudon, Marc Isolation of Picrotoxanes from <i>Austrobuxus carunculatus</i> Using Taxonomy-Based Molecular Networking. Journal of natural products, 2020, 83, 3069-3079 |
1559265 | CIF | C29 H42 O9 | P 1 | 7.9046; 10.2052; 17.7713 96.518; 91.665; 90.773 | 1423.5 | Olivon, Florent; Retailleau, Pascal; Desrat, Sandy; Touboul, David; Roussi, Fanny; Apel, Cécile; Litaudon, Marc Isolation of Picrotoxanes from <i>Austrobuxus carunculatus</i> Using Taxonomy-Based Molecular Networking. Journal of natural products, 2020, 83, 3069-3079 |
1559659 | CIF | C25 H33 N O7 | P 1 | 5.93; 10.095; 10.946 70.69; 81.62; 89.86 | 611.1 | Schjelderup, Lise; Groth, Per A.; Aasen, Arne Jorgen (R)-(‒)-1,1-Diphenyl-3-piperidinobutan-1-ol, an Anticholinergic Agent. The Crystal Structure of (R)-(‒)-1,1-Diphenyl-3-piperidiniobutan-1-ol (R,R)-tartrate Acta Chemica Scandinavica, 1990, 44, 284-287 |
1559734 | CIF | C15 H20 Br Cl N2 O2 | P 1 | 4.9505; 8.582; 19.942 88.027; 85.435; 89.121 | 843.98 | Steigerwald, Daniel C.; Soltanzadeh, Bardia; Sarkar, Aritra; Morgenstern, Cecilia C.; Staples, Richard J.; Borhan, Babak Ritter-enabled catalytic asymmetric chloroamidation of olefins. Chemical science, 2020, 12, 1834-1842 |
1559815 | CIF | C29 H46 O4 Si | P 1 | 6.44725; 10.18619; 22.76512 101.785; 91.4615; 98.5773 | 1444.75 | Huang, Qi; Suravarapu, Sankar Rao; Renaud, Philippe A Giese reaction for electron-rich alkenes. Chemical science, 2020, 12, 2225-2230 |
1560041 | CIF Paper | C20 H22 N4 O8 | P 1 | 7.7162; 8.9727; 16.9089 86.559; 78.838; 66.314 | 1051.59 | Rajkumar, Madhu; Desiraju, Gautam R. Quaternary and quinary molecular solids based on structural inequivalence and combinatorial approaches: 2-nitroresorcinol and 4,6-dichlororesorcinol IUCrJ, 2021, 8, 178-185 |
1560126 | CIF | C25 H18 O2 | P 1 | 8.6935; 11.1218; 12.2142 87.376; 70.785; 81.619 | 1103.26 | Yang, Chi; Wu, Tian-Rui; Li, Yan; Wu, Bing-Bing; Jin, Ruo-Xing; Hu, Duo-Duo; Li, Yuan-Bo; Bian, Kang-Jie; Wang, Xi-Sheng Facile synthesis of axially chiral styrene-type carboxylic acids via palladium-catalyzed asymmetric C‒H activation Chemical Science, 2021, 12, 3726-3732 |
1560262 | CIF | C57 H73 Cl2 N2 O3.5 P2 Ru | P 1 | 16.268; 17.763; 23.082 87.715; 81.35; 66.621 | 6051.3 | León, Félix; Comas-Vives, Aleix; Álvarez, Eleuterio; Pizzano, Antonio A combined experimental and computational study to decipher complexity in the asymmetric hydrogenation of imines with Ru catalysts bearing atropisomerizable ligands Catalysis Science & Technology, 2021, 11, 2497-2511 |
1560266 | CIF | C123 H142 Cl10 F4 N4 O6 P4 Ru2 | P 1 | 13.3642; 15.0349; 18.4697 89.212; 76.738; 66.771 | 3307.09 | León, Félix; Comas-Vives, Aleix; Álvarez, Eleuterio; Pizzano, Antonio A combined experimental and computational study to decipher complexity in the asymmetric hydrogenation of imines with Ru catalysts bearing atropisomerizable ligands Catalysis Science & Technology, 2021, 11, 2497-2511 |
1560319 | CIF | C256 H477 N60 O72.5 | P 1 | 9.61; 17.037; 49.01 83.751; 88.217; 74.756 | 7696 | Lee, Jin Woo; Collins, Jennifer E.; Wendt, Karen L.; Chakrabarti, Debopam; Cichewicz, Robert H. Leveraging Peptaibol Biosynthetic Promiscuity for Next-Generation Antiplasmodial Therapeutics. Journal of natural products, 2021, 84, 503-517 |
1560434 | CIF | Al4 B2 Ba5 N52 Si32 | P 1 | 9.7879; 9.792; 12.7226 96.074; 112.33; 94.08 | 1113.4 | Yoshimura, Fumitaka; Yamane, Hisanori; Nagasako, Makoto Synthesis and crystal structure of a new aluminum-silicon-nitride phosphor containing boron, Ba 5 B 2 Al 4 Si 32 N 52 :Eu Journal of Solid State Chemistry, 2017, 251, 43-49 |
1561140 | CIF | C78 H92 Co3 N12 O33 P2 | P 1 | 13.563; 13.5719; 13.6512 93.044; 110.683; 108.354 | 2192.77 | Huo, Liangqin; Fan, Liming; Zhang, Jie; Gao, Lingling; Zhai, Lijun; Wang, Xiaoqing; Hu, Tuoping Three novel coordination polymers based on tris(p-carboxyphenyl)phosphane oxide: Syntheses, structural characterization and magnetic properties Journal of Solid State Chemistry, 2018, 261, 37-42 |
1562031 | CIF | C30 H26 Cu3 N3 O21.5 | P 1 | 7.9985; 9.7296; 10.8506 84.315; 78.168; 75.064 | 797.6 | Mizzi, Jessica E.; Staples, Richard J.; LaDuca, Robert L. Temperature-dependent polymorphism and magnetic properties of three-dimensional copper pyromellitate coordination polymers containing 4,4′-dipyridylamine Journal of Solid State Chemistry, 2015, 225, 222-230 |
1562056 | CIF HKL Paper | C40 H54 Cl4 N4 O5 | P 1 | 9.5944; 12.7606; 18.0312 73.9951; 79.1246; 75.2203 | 2035.09 | Anderson, Grace I.; Bellia, Sophia; Zeller, Matthias; Hillesheim, Patrick C.; Mirjafari, Arsalan Quinine dihydrochloride hemihydrate IUCrData, 2021, 6, x210406 |
1562172 | CIF | C18 H24 O4 | P 1 | 10.0882; 11.6472; 14.4851 101.004; 106.6; 96.185 | 1577.07 | Hou, Min; Xu, Mengmeng; Yang, Baochao; He, Haibing; Gao, Shuanhu Construction of polycyclic structures with vicinal all-carbon quaternary stereocenters <i>via</i> an enantioselective photoenolization/Diels-Alder reaction. Chemical science, 2021, 12, 7575-7582 |
1562348 | CIF | C33.5 H40 O11.5 | P 1 | 11.938; 12.782; 12.925 118.386; 92.327; 114.237 | 1512.3 | Sadorn, Karoon; Saepua, Siriporn; Boonyuen, Nattawut; Choowong, Wilunda; Rachtawee, Pranee; Pittayakhajonwut, Pattama Bioactive Dimeric Tetrahydroxanthones with 2,2'- and 4,4'-Axial Linkages from the Entomopathogenic Fungus <i>Aschersonia confluens</i>. Journal of natural products, 2021, 84, 1149-1162 |
1562542 | CIF | C21 H32 O6 | P 1 | 9.8531; 10.0264; 11.2177 96.693; 102.932; 106.655 | 1015.23 | Kadir, Abdukriem; Zheng, Guijuan; Zheng, Xiaofeng; Jin, Pengfei; Maiwulanjiang, Maitinuer; Gao, Biao; Aisa, Haji Akber; Yao, Guangmin Structurally Diverse Diterpenoids from the Roots of <i>Salvia deserta</i> Based on Nine Different Skeletal Types. Journal of natural products, 2021, 84, 1442-1452 |
1562986 | CIF | C58 H41 Cd2 Cl2 N10 O40 P W12 | P 1 | 11.567; 12.931; 13.907 85.52; 80.98; 76.13 | 1992.7 | Wang, La-Mei; Fan, Yong; Wang, Yan; Xiao, Li-Na; Hu, Yang-Yang; Peng, Yu; Wang, Tie-Gang; Gao, Zhong-Min; Zheng, Da-Fang; Cui, Xiao-Bing; Xu, Ji-Qing First examples of hybrids based on polyoxometalates, metal halide clusters and organic ligands Journal of Solid State Chemistry, 2012, 191, 257-262 |
1563495 | CIF | C10 H16 N2 O28 U5 V4 | P 1 | 9.6981; 9.9966; 10.5523 117.194; 113.551; 92.216 | 802.85 | Jouffret, Laurent; Shao, Zhenmian; Rivenet, Murielle; Abraham, Francis New three-dimensional inorganic frameworks based on the uranophane-type sheet in monoamine templated uranyl-vanadates Journal of Solid State Chemistry, 2010, 183, 2290-2297 |
1563513 | CIF | C48 H24 Ce4 O26 | P 1 | 7.9053; 11.7211; 15.0873 111.667; 95.073; 102.134 | 1248.78 | Pizon, David; Henry, Natacha; Loiseau, Thierry; Roussel, Pascal; Abraham, Francis Synthesis, crystal structure and thermal behavior of two hydrated forms of lanthanide phthalates Ln2(O2+C6H4‒CO2)3(H2O) (Ln=Ce, Nd) and Nd2(O2C‒C6H4‒CO2)3(H2O)3 Journal of Solid State Chemistry, 2010, 183, 1943-1948 |
1563515 | CIF | C48 H24 Nd4 O28 | P 1 | 7.889; 11.57; 15.105 111.54; 95.57; 101.54 | 1234.3 | Pizon, David; Henry, Natacha; Loiseau, Thierry; Roussel, Pascal; Abraham, Francis Synthesis, crystal structure and thermal behavior of two hydrated forms of lanthanide phthalates Ln2(O2+C6H4‒CO2)3(H2O) (Ln=Ce, Nd) and Nd2(O2C‒C6H4‒CO2)3(H2O)3 Journal of Solid State Chemistry, 2010, 183, 1943-1948 |
1563560 | CIF | C15 H28 O3 | P 1 | 7.4494; 9.7601; 11.3665 76.475; 86.519; 67.953 | 744.41 | Varela, Kaitlyn; Arman, Hadi D.; Yoshimoto, Francis K. Synthesis of [15,15,15-2H3]-Dihydroartemisinic Acid and Isotope Studies Support a Mixed Mechanism in the Endoperoxide Formation to Artemisinin Journal of Natural Products, 2021 |
1563750 | CIF | C25 H29 N O3 | P 1 | 6.5078; 6.7349; 25.061 88.115; 87.858; 68.927 | 1024 | Wang, Fang-Xin; Yan, Jialei; Liu, Zhixin; Zhu, Tingshun; Liu, Yingguo; Ren, Shichao; Lv, Wen-Xin; Jin, Zhichao; Chi, Yonggui Robin Assembly of Multicyclic Isoquinoline Scaffolds from Pyridines: Formal Total Synthesis of Fredericamycin A Chemical Science, 2021 |
1563799 | CIF | C30 H28 Cl6 Cu2 N2 O12 | P 1 | 12.8223; 12.8239; 38.138 89.966; 89.948; 60.027 | 5432.4 | Salman, Yeşim; Barlas, Fırat Barış; Yavuz, Murat; Kaya, Kerem; Timur, Suna; Telli, Fatma Çetin Synthesis, characterization and biological application of dinuclear Cu(II) complexes of Schiff base ligands of galactochloralose and α-chloralose Inorganica Chimica Acta, 2018, 483, 98-105 |
1563979 | CIF | C34 H38 Cu2 N18 | P 1 | 8.2229; 10.5534; 11.6684 63.751; 89.079; 77.329 | 882.25 | Jana, Abhimanyu; Brandão, Paula; Mondal, Gopinath; Bera, Pradip; Santra, Ananyakumari; Jana, Atish Dipankar; Mokhamatam, Raveendra Babu; Manna, Sunil Kumar; Bhattacharyya, Nandan; Bera, Pulakesh Synthesis, characterization, cytotoxicity effect and DNA cleavage study of symmetric dinuclear chloro and azido bridged copper(II) complexes of napthyl-pyrazole based ligand Inorganica Chimica Acta, 2018, 482, 621-634 |
1564321 | CIF | C102.67 H88.67 Ca0.67 N25.67 O35.17 S6 | P 1 | 26.6387; 28.6958; 36.1958 84.231; 71.432; 87.032 | 26089.9 | Dengler, Sebastian; Mandal, Pradeep K.; Allmendinger, Lars; Douat, Céline; Huc, Ivan Conformational interplay in hybrid peptide‒helical aromatic foldamer macrocycles Chemical Science, 2021 |
1564323 | CIF | C58.25 H54.88 N15.62 O18.83 S3.02 | P 1 | 26.454; 27.9371; 30.9544 90.9437; 92.5505; 91.4316 | 22843.5 | Dengler, Sebastian; Mandal, Pradeep K.; Allmendinger, Lars; Douat, Céline; Huc, Ivan Conformational interplay in hybrid peptide‒helical aromatic foldamer macrocycles Chemical Science, 2021 |
1564531 | CIF | C21 H28 O6 | P 1 | 8.8662; 10.0457; 12.0334 84.282; 68.413; 89.829 | 990.99 | Cao, Yunfang; Tan, Xiaosheng; Al Chnani, Ali Adhab; Li, Pengkun; Shi, Zhengyi; Feng, Hao; Sun, Lingjuan; Xia, Qiangbing; Yang, Xi; Duan, Yulin; Guo, Yi; Chen, Gang; Qi, Changxing; Zhang, Yonghui Bioassay-Guided Isolation of an Abetiane-Type Diterpenoid from <i>Prunella vulgaris</i> That Protects against Concanavalin A-Induced Autoimmune Hepatitis. Journal of natural products, 2021, 84, 2189-2199 |
1564539 | CIF | C40 H53 N O2 | P 1 | 14.806; 15.4949; 17.248 111.348; 112.174; 95.359 | 3288.5 | Zhang, Hongyan; Ma, Huili; Huang, Wenbin; Gong, Wenqi; He, Zikai; Huang, Guangxi; Li, Bing Shi; Tang, Ben Zhong Controllable room temperature phosphorescence, mechanoluminescence and polymorphism of a carbazole derivative. Materials horizons, 2021, 8, 2816-2822 |
1564601 | CIF | C49 H69 Cl N6 | P 1 | 10.9057; 14.2504; 16.844 107.383; 104.681; 104.35 | 2263.3 | Hua, Bin; Ding, Yanjun; Alimi, Lukman O.; Moosa, Basem; Zhang, Gengwu; Baslyman, Walaa S.; Sessler, Jonathan; Khashab, Niveen M. Tuning the porosity of triangular supramolecular adsorbents for superior haloalkane isomer separations Chemical Science, 2021 |
1564627 | CIF | C32 H43 Cl2 Ir N2 O5 | P 1 | 7.85321; 10.98822; 20.4662 80.0645; 81.6655; 89.1459 | 1721.13 | Bandaru, Sravan K.; Thomas, Hayden P.; Saunders, Graham C. Piano stool complexes of N-heterocyclic carbene ligands bearing a galactose-derived substituent Inorganica Chimica Acta, 2020, 508, 119651 |
1564629 | CIF | C32.167 H43.333 Cl2.333 N2 O5 Rh | P 1 | 7.8667; 10.9861; 20.5635 79.89; 81.498; 89.261 | 1730.21 | Bandaru, Sravan K.; Thomas, Hayden P.; Saunders, Graham C. Piano stool complexes of N-heterocyclic carbene ligands bearing a galactose-derived substituent Inorganica Chimica Acta, 2020, 508, 119651 |
1564800 | CIF | C23 H31 Cl O5 | P 1 | 15.1437; 17.4925; 19.3925 105.337; 92.858; 113.621 | 4467.9 | Luo, Xiaowei; Cai, Guodi; Guo, Yinfeng; Gao, Chenghai; Huang, Weifeng; Zhang, Zhenhua; Lu, Humu; Liu, Kai; Chen, Jianghe; Xiong, Xiaofeng; Lei, Jinping; Zhou, Xuefeng; Wang, Junjian; Liu, Yonghong Exploring Marine-Derived Ascochlorins as Novel Human Dihydroorotate Dehydrogenase Inhibitors for Treatment of Triple-Negative Breast Cancer. Journal of medicinal chemistry, 2021, 64, 13918-13932 |
1564802 | CIF | C23 H29 Cl O5 | P 1 | 6.1316; 11.209; 16.0507 90.884; 100.853; 93.813 | 1080.58 | Luo, Xiaowei; Cai, Guodi; Guo, Yinfeng; Gao, Chenghai; Huang, Weifeng; Zhang, Zhenhua; Lu, Humu; Liu, Kai; Chen, Jianghe; Xiong, Xiaofeng; Lei, Jinping; Zhou, Xuefeng; Wang, Junjian; Liu, Yonghong Exploring Marine-Derived Ascochlorins as Novel Human Dihydroorotate Dehydrogenase Inhibitors for Treatment of Triple-Negative Breast Cancer. Journal of medicinal chemistry, 2021, 64, 13918-13932 |
1565111 | CIF | C26 H32 O10 | P 1 | 8.2185; 8.4465; 10.2022 112.706; 95.017; 110.165 | 593.06 | Huang, Zhong-Hui; Liang, Xiao; Li, Chan-Juan; Gu, Qiong; Ma, Xuan; Qi, Shu-Hua Talaromynoids A-I, Highly Oxygenated Meroterpenoids from the Marine-Derived Fungus <i>Talaromyces purpureogenus</i> SCSIO 41517 and Their Lipid Accumulation Inhibitory Activities. Journal of natural products, 2021, 84, 2727-2737 |
1565122 | CIF | C30 H28 S2 | P 1 | 6.0023; 8.1084; 24.3715 98.319; 94.455; 92.83 | 1167.9 | Sumitomo, Kenta; Sudo, Yuta; Kanazawa, Kiseki; Kawabata, Kohsuke; Takimiya, Kazuo Enantiopure 2-(2-ethylhexyl)dinaphtho[2,3-<i>b</i>:2',3'-<i>f</i>]thieno[3,2-<i>b</i>]thiophenes: synthesis, single-crystal structure and a surprising lack of influence of stereoisomerism on thin-film structure and electronic properties. Materials horizons, 2022, 9, 444-451 |
1565123 | CIF | C30 H28 S2 | P 1 | 6.0173; 8.1041; 24.3262 98.542; 94.452; 92.932 | 1167.2 | Sumitomo, Kenta; Sudo, Yuta; Kanazawa, Kiseki; Kawabata, Kohsuke; Takimiya, Kazuo Enantiopure 2-(2-ethylhexyl)dinaphtho[2,3-<i>b</i>:2',3'-<i>f</i>]thieno[3,2-<i>b</i>]thiophenes: synthesis, single-crystal structure and a surprising lack of influence of stereoisomerism on thin-film structure and electronic properties. Materials horizons, 2022, 9, 444-451 |
1565340 | CIF | C21 H14 Cl4 I N O2 | P 1 | 8.2099; 11.6051; 12.1577 87.954; 80.589; 89.897 | 1142.02 | Shen, Chong; Cheng, Xiang; Wei, Liang; Wang, Ruo-Qing; Wang, Chun-Jiang Stereodivergent Synthesis via Iridium-Catalyzed Asymmetric Double Allylic Alkylation of Cyanoacetate Chemical Science, 2021 |
1565422 | CIF | C23 H34 B10 Cl3 D N2 O3 S | P 1 | 10.54; 12.1568; 14.1284 71.811; 76.438; 65.487 | 1553.3 | Cao, Hou-Ji; Wei, Xing; Sun, Fangxiang; Zhang, Xiaolei; Lu, Changsheng; Yan, Hong Metal-catalyzed B–H acylmethylation of pyridylcarboranes: access to carborane-fused indoliziniums and quinoliziniums Chemical Science, 2021 |
1565423 | CIF | C16 H22 B10 O | P 1 | 12.097; 13.28; 13.603 70.744; 72.905; 70.884 | 1906 | Cao, Hou-Ji; Wei, Xing; Sun, Fangxiang; Zhang, Xiaolei; Lu, Changsheng; Yan, Hong Metal-catalyzed B–H acylmethylation of pyridylcarboranes: access to carborane-fused indoliziniums and quinoliziniums Chemical Science, 2021 |
1565513 | CIF | C20 H30 O4 | P 1 | 6.0177; 12.9026; 13.0816 117.122; 90.99; 92.129 | 902.73 | Qi, Jing-Jing; Zhou, Jun-Su; Zhang, Yan; Fan, Yao-Yue; Zhou, Bin; Liu, Hong-Chun; Zhao, Jin-Xin; Yue, Jian-Min Sublyratins A-O, Labdane-Type Diterpenoids from <i>Croton sublyratus</i>. Journal of natural products, 2021, 84, 2971-2980 |
1565822 | CIF | C23 H20 I N O2 | P 1 | 8.7754; 8.8984; 12.8772 99.2233; 96.0361; 91.197 | 986.31 | Dishman, Sarah N.; Laconsay, Croix J.; Fettinger, James C.; Tantillo, Dean J.; Shaw, Jared T. Divergent stereochemical outcomes in the insertion of donor/donor carbenes into the C–H bonds of stereogenic centers Chemical Science, 2022, 13, 1030-1036 |
1565823 | CIF | C33 H27 N O3 | P 1 | 6.3151; 11.198; 17.7567 85.4422; 85.449; 86.8128 | 1246.24 | Dishman, Sarah N.; Laconsay, Croix J.; Fettinger, James C.; Tantillo, Dean J.; Shaw, Jared T. Divergent stereochemical outcomes in the insertion of donor/donor carbenes into the C–H bonds of stereogenic centers Chemical Science, 2022, 13, 1030-1036 |
1565825 | CIF HKL Paper | C7 H16 O7 | P 1 | 6.732; 7.7574; 10.6128 82.458; 72.596; 65.476 | 481.13 | Matsumoto, Mao; Nagayama, Natsumi; Hirose, Ryo; Takeshita, Kei; Ishii, Tomohiko Methyl α-<small>L</small>-sorboside monohydrate IUCrData, 2021, 6, x211325 |
1566046 | CIF | C16 H19 N O3 S | P 1 | 7.6588; 7.9714; 12.8907 99.211; 90.731; 99.142 | 766.39 | Iwumene, Ndidi U. N.; Moseley, Daniel. F.; Pullin, Robert D. C.; Willis, Michael C. Diverse saturated heterocycles from a hydroacylation/conjugate addition cascade Chemical Science, 2022, 13, 1504-1511 |
1566136 | CIF | C15 H16 N2 O3 S | P 1 | 14.9664; 14.9764; 47.378 88.856; 87.71; 60.02 | 9191.2 | Jakkaraj, Sudhakar R.; Young, Victor G.; Georg, Gunda I. Syntheses of PDE3A inhibitor ORG9935 and determination of the absolute stereochemistries of its enantiomers by X-ray crystallography Tetrahedron, 2018, 74, 2769-2774 |
1566234 | CIF | Ca0.458 Mo0.8 O8.315 U1.2 | P 1 | 3.9375; 11.2613; 14.195 84.4274; 112.499; 133.944 | 405.053 | Gwladys Steciuk; Radek Skoda; Jan Rohlicek; Jakub Plasil Crystal structure of the uranyl-molybdate mineral calcurmolite Ca[(UO2)3(MoO4)2(OH)4](H2O)5 : insights from a precession electron-diffraction tomography study Journal of GeoSciences, 2020, 65, 15-25 |
1566282 | CIF | C32 H34 O11 | P 1 | 7.3468; 9.587; 10.3986 71.686; 80.813; 86.65 | 686.37 | Cao, Hai-Yan; Yi, Cheng; Sun, Sen-Feng; Li, Yong; Liu, Yun-Bao Anti-inflammatory Dimeric Tetrahydroxanthones from an Endophytic <i>Muyocopron laterale</i>. Journal of natural products, 2022, 85, 148-161 |
1566283 | CIF | C33 H40 O14 | P 1 | 7.2806; 9.8268; 11.0309 85.062; 88.911; 86.614 | 784.83 | Cao, Hai-Yan; Yi, Cheng; Sun, Sen-Feng; Li, Yong; Liu, Yun-Bao Anti-inflammatory Dimeric Tetrahydroxanthones from an Endophytic <i>Muyocopron laterale</i>. Journal of natural products, 2022, 85, 148-161 |
1566357 | CIF | Al2 H4 O9 Si2 | P 1 | 5.185369; 8.997871; 7.347378 91.7552; 105.095; 89.8358 | 330.82 | Richard, D; Rendtorff, N M Kaolin group minerals under pressure: The study of their structural and electronic properties by DFT methods Applied Clay Science, 2022, 219, 106444-106444 |
1566358 | CIF | Al2 H4 O9 Si2 | P 1 | 5.210756; 5.189703; 7.581904 89.3723; 72.4369; 119.963 | 166.073 | Richard, D; Rendtorff, N M Kaolin group minerals under pressure: The study of their structural and electronic properties by DFT methods Applied Clay Science, 2022, 219, 106444-106444 |
1566359 | CIF | Al2 H4 O9 Si2 | P 1 | 5.162169; 5.176777; 7.781752 104.444; 98.2915; 119.884 | 165.438 | Richard, D; Rendtorff, N M Kaolin group minerals under pressure: The study of their structural and electronic properties by DFT methods Applied Clay Science, 2022, 219, 106444-106444 |
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