Crystallography Open Database
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Searching space group like 'P b c a'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1515375 | CIF | C15 H22 N2 O S | P b c a | 7.756; 10.12; 37.38 90; 90; 90 | 2934 | Busschaert, Nathalie; Bradberry, Samuel J.; Wenzel, Marco; Haynes, Cally J. E.; Hiscock, Jennifer R.; Kirby, Isabelle L.; Karagiannidis, Louise E.; Moore, Stephen J.; Wells, Neil J.; Herniman, Julie; Langley, G. John; Horton, Peter N.; Light, Mark E.; Marques, Igor; Costa, Paulo J.; Félix, Vítor; Frey, Jeremy G.; Gale, Philip A. Towards predictable transmembrane transport: QSAR analysis of anion binding and transport Chemical Science, 2013, 4, 3036 |
| 1515448 | CIF | C17 H19 N O2 | P b c a | 7.7628; 11.1348; 32.262 90; 90; 90 | 2788.6 | Faustino, Hélio; López, Fernando; Castedo, Luis; Mascareñas, José L. Gold(i)-catalyzed intermolecular (4 + 2) cycloaddition of allenamides and acyclic dienes Chemical Science, 2011, 2, 633 |
| 1515463 | CIF | C47 H46 F12 N8 P2 Pt2 | P b c a | 18.526; 22.046; 23.559 90; 90; 90 | 9622 | Wai-Yin Sun, Raymond; Lok-Fung Chow, Andy; Li, Xiao-Hua; Yan, Jessie Jing; Sin-Yin Chui, Stephen; Che, Chi-Ming Luminescent cyclometalated platinum(ii) complexes containing N-heterocyclic carbene ligands with potent in vitro and in vivo anti-cancer properties accumulate in cytoplasmic structures of cancer cells Chemical Science, 2011, 2, 728 |
| 1515476 | CIF | C34 H69 P5 Pt2 | P b c a | 11.699; 15.37; 45.229 90; 90; 90 | 8133 | Waterman, Rory; Tilley, T. Don Terminal hafnium phosphinidene complexes and phosphinidene ligand exchange Chemical Science, 2011, 2, 1320 |
| 1515527 | CIF | C16 H22 N2 O2 S | P b c a | 12.3076; 9.776; 26.6952 90; 90; 90 | 3211.94 | Lu, Hongjian; Jiang, Huiling; Hu, Yang; Wojtas, Lukasz; Zhang, X. Peter Chemoselective intramolecular allylic C–H amination versus CC aziridination through Co(ii)-based metalloradical catalysis Chemical Science, 2011, 2, 2361 |
| 1515535 | CIF | C17 H22 O3 | P b c a | 12.7496; 10.619; 22.4445 90; 90; 90 | 3038.7 | Parr, Brendan T.; Li, Zhanjie; Davies, Huw M. L. Asymmetric Synthesis of Highly Functionalized Cyclopentanes by a Rhodium- and Scandium-Catalyzed Five-Step Domino Sequence. Chemical science (Royal Society of Chemistry : 2010), 2011, 2, 2378-2382 |
| 1515570 | CIF | C15 H10 Br2 N2 | P b c a | 18.7505; 7.0987; 20.0419 90; 90; 90 | 2667.7 | Vecchione, Matthew K.; Sun, Aaron X.; Seidel, Daniel Divergent reactions of indoles with aminobenzaldehydes: indole ring-opening vs. annulation and facile synthesis of neocryptolepine Chemical Science, 2011, 2, 2178 |
| 1515587 | CIF | C40 H63 N3 O3 Si Ti | P b c a | 19.9166; 19.1716; 21.779 90; 90; 90 | 8315.9 | Silvia, Jared S.; Cummins, Christopher C. Binding, release, and functionalization of CO2 at a nucleophilic oxo anion complex of titanium Chemical Science, 2011, 2, 1474 |
| 1515637 | CIF | C56 H88 N32 Ni4 O16 | P b c a | 17.3775; 17.494; 24.6892 90; 90; 90 | 7505.6 | Alkordi, Mohamed H.; Belof, Jonathan L.; Rivera, Edwin; Wojtas, Lukasz; Eddaoudi, Mohamed Insight into the construction of metal‒organic polyhedra: metal‒organic cubes as a case study Chemical Science, 2011, 2, 1695 |
| 1515668 | CIF | C36 H36 B F12 N2 O P | P b c a | 19.5019; 16.3963; 21.7273 90; 90; 90 | 6947.5 | Neu, Rebecca C.; Otten, Edwin; Lough, Alan; Stephan, Douglas W. The synthesis and exchange chemistry of frustrated Lewis pair–nitrous oxide complexes Chemical Science, 2011, 2, 170 |
| 1515693 | CIF | C28 H36 N2 O12 Zn | P b c a | 11.8469; 8.7118; 28.9529 90; 90; 90 | 2988.2 | Kawarada, Hikaru; Yoshikawa, Yutaka; Yasui, Hiroyuki; Kuwahara, Shunsuke; Habata, Yoichi; Saito, Ryota Synthesis and in vitro insulin-mimetic activities of zinc(ii) complexes of ethyl 2,5-dihydro-4-hydroxy-5-oxo-1H-pyrrole-3-carboxylates. Metallomics : integrated biometal science, 2011, 3, 675-679 |
| 1515695 | CIF | C20 H17 Fe N O | P b c a | 17.4825; 7.342; 23.1152 90; 90; 90 | 2966.99 | Spencer, John; Amin, Jahangir; Callear, Samantha K.; Tizzard, Graham J.; Coles, Simon J.; Coxhead, Peter; Guille, Matthew Synthesis and evaluation of metallocene containing methylidene-1,3-dihydro-2H-indol-2-ones as kinase inhibitors. Metallomics : integrated biometal science, 2011, 3, 600-608 |
| 1515722 | CIF | C13 H10 F N | P b c a | 7.5432; 11.7934; 11.8041 90; 90; 90 | 1050.09 | Mondal, Barnali; Captain, Burjor; Ramamurthy, V. Photodimerization of HCl salts of azastilbenes in the solid state. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2011, 10, 891-894 |
| 1515812 | CIF | C38 H50 N P2 V | P b c a | 18.1601; 19.1808; 20.2261 90; 90; 90 | 7045.3 | Andino, José G.; Kilgore, Uriah J.; Pink, Maren; Ozarowski, Andrew; Krzystek, J.; Telser, Joshua; Baik, Mu-Hyun; Mindiola, Daniel J. Intermolecular C‒H bond activation of benzene and pyridines by a vanadium(iii) alkylidene including a stepwise conversion of benzene to a vanadium-benzyne complex Chemical Science, 2010, 1, 351 |
| 1515873 | CIF | C15 H18 O4 | P b c a | 10.8837; 9.9484; 24.339 90; 90; 90 | 2635.3 | Kandur, Wynne V.; Richert, Kathleen J.; Rieder, Curtis J.; Thomas, Andrew M.; Hu, Chunhua; Ziller, Joseph W.; Woerpel, K. A. Synthesis and Reactivity of 1,2-Dioxolanes from β,γ-Epoxy Ketones. Organic letters, 2014, 16, 2650-2653 |
| 1515887 | CIF | C25 H22 N2 O3 | P b c a | 12.8758; 17.5058; 18.2986 90; 90; 90 | 4124.53 | Alam, Rauful; Das, Arindam; Huang, Genping; Eriksson, Lars; Himo, Fahmi; Szabó, Kálmán J. Stereoselective allylboration of imines and indoles under mild conditions. An in situ E/Z isomerization of imines by allylboroxines Chemical Science, 2014, 5, 2732 |
| 1515919 | CIF | C23 H15 B F2 N2 | P b c a | 13.0065; 12.4226; 21.8351 90; 90; 90 | 3528 | Benniston, Andrew C.; Harriman, Anthony; Whittle, Victoria L.; Zelzer, Mischa; Harrington, Ross W.; Clegg, William Exciplex-like emission from a closely-spaced, orthogonally-sited anthracenyl-boron dipyrromethene (Bodipy) molecular dyad. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2010, 9, 1009-1017 |
| 1515927 | CIF | C22 H19 N | P b c a | 16.1137; 8.8958; 22.983 90; 90; 90 | 3294.5 | Greenberg, Sharonna; Stephan, Douglas W. Hydroamination as a route to nitrogen-containing oligomers Polymer Chemistry, 2010, 1, 1332 |
| 1515983 | CIF | C36 H44 N4 O4 | P b c a | 12.802; 19.593; 25.555 90; 90; 90 | 6410 | Dethe, Dattatraya H.; Erande, Rohan D.; Dherange, Balu D. Remarkable switch of regioselectivity in diels-alder reaction: divergent total synthesis of borreverine, caulindoles, and flinderoles. Organic letters, 2014, 16, 2764-2767 |
| 1515984 | CIF | C40 H46 N2 O8 S2 | P b c a | 29.124; 8.811; 29.171 90; 90; 90 | 7486 | Dethe, Dattatraya H.; Erande, Rohan D.; Dherange, Balu D. Remarkable switch of regioselectivity in diels-alder reaction: divergent total synthesis of borreverine, caulindoles, and flinderoles. Organic letters, 2014, 16, 2764-2767 |
| 1515988 | CIF | C36 H36 N4 O4 | P b c a | 10.915; 10.002; 27.209 90; 90; 90 | 2970.5 | Culf, Adrian S.; Cuperlović-Culf, Miroslava; Léger, Daniel A; Decken, Andreas Small Head-to-Tail Macrocyclic α-Peptoids. Organic letters, 2014, 16, 2780-2783 |
| 1516061 | CIF | C17 H22 N2 O3 | P b c a | 9.5653; 10.45; 30.655 90; 90; 90 | 3064.2 | Hirschhäuser, Christoph; Parker, Jeremy S.; Perry, Matthew W. D.; Haddow, Mairi F.; Gallagher, Timothy Spiro-fused pyrrolidine, piperidine, and oxindole scaffolds from lactams. Organic letters, 2012, 14, 4846-4849 |
| 1516140 | CIF | C48 H47.38 B Cl Ir N4 O0.19 | P b c a | 16.815; 17.575; 28.6833 90; 90; 90 | 8476.59 | Woods, James A.; Lalrempuia, Ralte; Petronilho, Ana; McDaniel, Neal D.; Müller-Bunz, Helge; Albrecht, Martin; Bernhard, Stefan Carbene iridium complexes for efficient water oxidation: scope and mechanistic insights Energy & Environmental Science, 2014, 7, 2316 |
| 1516172 | CIF | C10 H9 B F2 N4 | P b c a | 12.306; 9.48; 18.766 90; 90; 90 | 2189.3 | Yu, Changjiang; Jiao, Lijuan; Zhang, Ping; Feng, Zeya; Cheng, Chi; Wei, Yun; Mu, Xiaolong; Hao, Erhong Highly Fluorescent BF2 Complexes of Hydrazine-Schiff Base Linked Bispyrrole. Organic letters, 2014, 16, 3048-3051 |
| 1516235 | CIF | C13 H16 O6 | P b c a | 11.5879; 11.617; 19.7761 90; 90; 90 | 2662.19 | Rout, Saroj Kumar; Guin, Srimanta; Ali, Wajid; Gogoi, Anupal; Patel, Bhisma K. Copper-Catalyzed Esterification of Alkylbenzenes with Cyclic Ethers and Cycloalkanes via C(sp(3))-H Activation Following Cross-Dehydrogenative Coupling. Organic letters, 2014, 16, 3086-3089 |
| 1516265 | CIF | C24 H16 N2 O | P b c a | 14.7042; 8.8119; 27.6407 90; 90; 90 | 3581.46 | Dong, Jiaxing; Wang, Fei; You, Jingsong Copper-Mediated Tandem Oxidative C(sp(2))-H/C(sp)-H Alkynylation and Annulation of Arenes with Terminal Alkynes. Organic letters, 2014, 16, 2884-2887 |
| 1516273 | CIF | C76 H118 B2 K2 O8 | P b c a | 16.1537; 19.955; 22.8279 90; 90; 90 | 7358.5 | Araneda, Juan F.; Piers, Warren E.; Sgro, Michael J.; Parvez, Masood Bronsted acid-catalyzed skeletal rearrangements in polycyclic conjugated boracycles: a thermal route to a ladder diborole Chemical Science, 2014, 5, 3189 |
| 1516332 | CIF | C38 H55 F3 O3 P2 Pd S Si | P b c a | 23.517; 21.766; 14.71 90; 90; 90 | 7530 | Suh, Hee-Won; Guard, Louise M.; Hazari, Nilay A mechanistic study of allene carboxylation with CO2resulting in the development of a Pd(ii) pincer complex for the catalytic hydroboration of CO2 Chemical Science, 2014, 5, 3859 |
| 1516376 | CIF | C10 H14 N4 O6 | P b c a | 17.4174; 7.0176; 19.344 90; 90; 90 | 2364.39 | Naumov, Pance; Lee, Sang Cheol; Ishizawa, Nobuo; Jeong, Young Gyu; Chung, Ihn Hee; Fukuzumi, Shunichi New type of dual solid-state thermochromism: modulation of intramolecular charge transfer by intermolecular pi-pi interactions, kinetic trapping of the aci-nitro group, and reversible molecular locking. The journal of physical chemistry. A, 2009, 113, 11354-11366 |
| 1516381 | CIF | C23 H18 N2 | P b c a | 15.7; 6.8425; 33.139 90; 90; 90 | 3560 | Yang, Jye-Shane; Lin, Cheng-Kai; Lahoti, Anand M.; Tseng, Chung-Kai; Liu, Yi-Hung; Lee, Gene-Hsiang; Peng, Shie-Ming Effect of ground-state twisting on the trans –> cis photoisomerization and TICT state formation of aminostilbenes. The journal of physical chemistry. A, 2009, 113, 4868-4877 |
| 1516462 | CIF | C29 H22 N2 O2 S | P b c a | 19.6725; 18.2791; 12.5149 90; 90; 90 | 4500.3 | Tokimizu, Yusuke; Oishi, Shinya; Fujii, Nobutaka; Ohno, Hiroaki Gold-Catalyzed Cascade Cyclization of (Azido)ynamides: An Efficient Strategy for the Construction of Indoloquinolines. Organic letters, 2014, 16, 3138-3141 |
| 1516490 | CIF | C19 H14 O2 | P b c a | 26.9628; 15.3036; 6.9176 90; 90; 90 | 2854.39 | Sundaryono, Agus; Nourmamode, Aziz; Gardrat, Christian; Grelier, Stéphane; Bravic, Georges; Chasseau, Daniel; Castellan, Alain Studies on the photochemistry of 1,7-diphenyl-1,6-heptadiene-3,5-dione, a non-phenolic curcuminoid model Photochemical & Photobiological Sciences, 2003, 2, 914-920 |
| 1516498 | CIF | C34 H28 N2 O4 | P b c a | 16.1351; 15.7795; 21.2316 90; 90; 90 | 5405.6 | Frischmann, Peter D.; Jiang, Jian; Hui, Joseph K.-H.; Grzybowski, Joseph J.; MacLachlan, Mark J. Reversible-irreversible approach to Schiff base macrocycles: access to isomeric macrocycles with multiple salphen pockets. Organic letters, 2008, 10, 1255-1258 |
| 1516538 | CIF | C30 H45 As2 Cr3 | P b c a | 15.3898; 18.4053; 21.8004 90; 90; 90 | 6175.05 | Reisinger, Sabine; Bodensteiner, Michael; Pineda, Eufemio Moreno; McDouall, Joseph J. W.; Scheer, Manfred; Layfield, Richard A. Addition of pnictogen atoms to chromium(ii): synthesis, structure and magnetic properties of a chromium(iv) phosphide and a chromium(iii) arsenide Chemical Science, 2014, 5, 2443 |
| 1516562 | CIF | C15 H29 B N2 | P b c a | 14.3661; 12.0848; 18.962 90; 90; 90 | 3292 | Braunschweig, Holger; Kramer, Thomas; Radacki, Krzysztof; Shang, Rong; Siedler, Eva; Werner, Christine Isolation of the key intermediates of base-promoted borylene–carbonyl coupling reactions Chemical Science, 2014, 5, 2271 |
| 1516588 | CIF | C47 H73 N Si Th | P b c a | 10.4251; 20.765; 44.289 90; 90; 90 | 9587.6 | Ren, Wenshan; Zhou, Enwei; Fang, Bo; Zi, Guofu; Fang, De-Cai; Walter, Marc D. Si‒H addition followed by C‒H bond activation induced by a terminal thorium imido metallocene: a combined experimental and computational study Chemical Science, 2014, 5, 3165 |
| 1516611 | CIF | C17 H14 N2 O3 | P b c a | 11.398; 15.357; 16.312 90; 90; 90 | 2855.2 | Griesbeck, Axel G.; Kramer, Wolfgang; Heinrich, Thomas; Lex, Johann Photocyclization of N,N-phthaloylanthranilic amides coupled to ω-amino acids with increasing chain lengths Photochemical & Photobiological Sciences, 2002, 1, 237 |
| 1516617 | CIF | C23 H25 N O2 | P b c a | 17.47; 11.704; 18.731 90; 90; 90 | 3829.9 | Hopfner, Matthias; Weiß, Harald; Meissner, Dieter; Heinemann, Frank W.; Kisch, Horst Semiconductor photocatalysis type B: synthesis of unsaturated α-amino esters from imines and olefins photocatalyzed by silica-supported cadmium sulfide Photochemical & Photobiological Sciences, 2002, 1, 696-703 |
| 1516718 | CIF | C33 H28 N2 O2 | P b c a | 12.859; 15.737; 25.688 90; 90; 90 | 5198 | Li, Ruohan; Xiao, Shuzhang; Li, Yi; Lin, Qifei; Zhang, Ronghua; Zhao, Jun; Yang, Changying; Zou, Kun; Li, Dongsheng; Yi, Tao Polymorphism-dependent and piezochromic luminescence based on molecular packing of a conjugated molecule Chemical Science, 2014, 5, 3922 |
| 1516720 | CIF | C33 H28 N2 O2 | P b c a | 12.852; 15.692; 25.641 90; 90; 90 | 5171 | Li, Ruohan; Xiao, Shuzhang; Li, Yi; Lin, Qifei; Zhang, Ronghua; Zhao, Jun; Yang, Changying; Zou, Kun; Li, Dongsheng; Yi, Tao Polymorphism-dependent and piezochromic luminescence based on molecular packing of a conjugated molecule Chemical Science, 2014, 5, 3922 |
| 1516741 | CIF | C17 H12 O3 S2 | P b c a | 11.2885; 14.123; 17.4374 90; 90; 90 | 2780 | Sugiyasu, Kazunori; Song, Changsik; Swager, Timothy M. Aromaticity in Tropone-Containing Polythiophene Macromolecules, 2006, 39, 5598 |
| 1516746 | CIF | C24 H18 B N O3 | P b c a | 14.8638; 15.4624; 16.3768 90; 90; 90 | 3763.9 | Yasuda, Makoto; Yoshioka, Sachiko; Yamasaki, Satoshi; Somyo, Toshio; Chiba, Kouji; Baba, Akio Cage-shaped borate esters with enhanced Lewis acidity and catalytic activity. Organic letters, 2006, 8, 761-764 |
| 1516760 | CIF | C11 H11 Br O2 S | P b c a | 7.4039; 12.927; 24.736 90; 90; 90 | 2367.5 | Weatherhead-Kloster, Robin A; Corey, E. J. Theory-guided discovery of unique chemical transformations of cyclopropenes. Organic letters, 2006, 8, 171-174 |
| 1516866 | CIF | C18 H12 I2 N2 O2 Pb2 | P b c a | 9.4814; 11.835; 17.835 90; 90; 90 | 2001.3 | Ezzatollah Najafi; Mostafa M. Amini; Ezeddin Mohajerani; Mohammad Janghouri; Hossein Razavi; Hamidreza Khavasi Fabrication of an organic light-emitting diode (OLED) from a two-dimensional lead(II) coordination polymer Inorganica Chimica Acta, 2013, 399, 119-125 |
| 1516867 | CIF | C23 H32 Co K N4 O5 | P b c a | 11.6732; 15.9989; 25.6674 90; 90; 90 | 4793.6 | Ryoji Mitsuhashi; Takayoshi Suzuki; Yukinari Sunatsuki; Masaaki Kojima Hydrogen-bonding interactions, geometrical selectivity and spectroscopic properties of cobalt(III) complexes with unsymmetrical tridentate amine-amidato-phenolato type ligands Inorganica Chimica Acta, 2013, 399, 131-137 |
| 1516882 | CIF | C14 H13 I O2 | P b c a | 7.8201; 15.7081; 21.1791 90; 90; 90 | 2601.6 | Yang, Yanping; Cui, Mengchao; Zhang, Xiaoyang; Dai, Jiapei; Zhang, Zhiyong; Lin, Chunping; Guo, Yuzhi; Liu, Boli Radioiodinated Benzyloxybenzene Derivatives: A Class of Flexible Ligands Target to β-Amyloid Plaques in Alzheimer's Brains. Journal of medicinal chemistry, 2014, 57, 6030-6042 |
| 1516889 | CIF | C50 H78 O4 Si4 U2 | P b c a | 10.48; 21.616; 23.669 90; 90; 90 | 5361.9 | Tsoureas, Nikolaos; Castro, Ludovic; Kilpatrick, Alexander F. R.; Cloke, F. Geoffey N.; Maron, Laurent Controlling selectivity in the reductive activation of CO2by mixed sandwich uranium(iii) complexes Chemical Science, 2014, 5, 3777 |
| 1516905 | CIF | C16 H26 N4 Ni O8 | P b c a | 8.884; 12.611; 15.885 90; 90; 90 | 1779.7 | Jing Jin; Yu Ding; Yuan-Yuan Gong; Sheng-Mei Cong; Yu-Xian Chi; Guang-Ning Zhang; Shu-Yun Niu Synthesis, structure and surface photo-electric property of Ni(II) complexes Inorganica Chimica Acta, 2013, 399, 227-235 |
| 1516966 | CIF | C23 H22 N2 O | P b c a | 9.3932; 18.3398; 23.3368 90; 90; 90 | 4020.2 | Das, Arindam; Alam, Rauful; Eriksson, Lars; Szabó, Kálmán J Stereocontrol in synthesis of homoallylic amines. Syn selective direct allylation of hydrazones with allylboronic acids. Organic letters, 2014, 16, 3808-3811 |
| 1517007 | CIF | C51 H44 Cl2 N4 Zn | P b c a | 10.2526; 22.0749; 38.2732 90; 90; 90 | 8662.2 | Markus Graser; Holger Kopacka; Klaus Wurst; Thomas Muller; Benno Bildstein Structurally diverse pyridyl or quinolyl enolato/enamido metal complexes of Li, Zr, Fe, Co, Ni, Cu and Zn Inorganica Chimica Acta, 2013, 401, 38-49 |
| 1517016 | CIF | C47 H36 Mn3 N4 O13 S6 | P b c a | 19.1258; 23.0759; 23.544 90; 90; 90 | 10391 | Reda F.M. Elshaarawy; Yanhua Lan; Christoph Janiak Oligonuclear homo- and mixed-valence manganese complexes based on thiophene- or aryl-carboxylate ligation: Synthesis, characterization and magnetic studies Inorganica Chimica Acta, 2013, 401, 85-94 |
| 1517017 | CIF | C45 H33 Mn3 N3 O14 S6 | P b c a | 18.974; 22.931; 23.64 90; 90; 90 | 10286 | Reda F.M. Elshaarawy; Yanhua Lan; Christoph Janiak Oligonuclear homo- and mixed-valence manganese complexes based on thiophene- or aryl-carboxylate ligation: Synthesis, characterization and magnetic studies Inorganica Chimica Acta, 2013, 401, 85-94 |
| 1517020 | CIF | C22 H26 N2 O4 | P b c a | 11.5485; 16.5802; 20.5991 90; 90; 90 | 3944.24 | Schurgers, Ben; Brigou, Ben; Urbanczyk-Lipkowska, Zofia; Tourwé, Dirk; Ballet, Steven; De Proft, Frank; Van Lommen, Guy; Verniest, Guido Synthesis of Fused 3-Aminoazepinones via Trapping of a New Class of Cyclic Seven-Membered Allenamides with Furan. Organic letters, 2014, 16, 3712-3715 |
| 1517097 | CIF | C13 H14 Mo O5 | P b c a | 10.3022; 11.1065; 23.6758 90; 90; 90 | 2709 | Grover, Nidhi; Pöthig, Alexander; Kühn, Fritz E. Cyclopentadienyl molybdenum alkyl ester complexes as catalyst precursors for olefin epoxidation Catal. Sci. Technol., 2014, 4, 4219 |
| 1517175 | CIF | C9 H18 Br3 Fe Ga O3 P2 | P b c a | 17.8212; 16.529; 26.155 90; 90; 90 | 7704.4 | Braunschweig, Holger; Dewhurst, Rian D.; Hupp, Florian; Kaufmann, Christina; Phukan, Ashwini K.; Schneider, Christoph; Ye, Qing Gauging metal Lewis basicity of zerovalent iron complexes via metal-only Lewis pairs Chemical Science, 2014, 5, 4099 |
| 1517236 | CIF | C14 H13 N O5 | P b c a | 6.9386; 15.1121; 23.6998 90; 90; 90 | 2485.09 | Logan, Angus W. J.; Sprague, Simon J.; Foster, Robert W.; Marx, Léo B; Garzya, Vincenzo; Hallside, Michal S.; Thompson, Amber L.; Burton, Jonathan W. Diastereoselective synthesis of fused lactone-pyrrolidinones; application to a formal synthesis of (-)-salinosporamide a. Organic letters, 2014, 16, 4078-4081 |
| 1517254 | CIF | C22 H25 N3 O2 | P b c a | 11.1623; 13.076; 27.158 90; 90; 90 | 3963.9 | Galvez, Jaime; Castillo, Juan-Carlos; Quiroga, Jairo; Rajzmann, Michel; Rodriguez, Jean; Coquerel, Yoann Divergent Chemo-, Regio-, and Diastereoselective Normal Electron-Demand Povarov-Type Reactions with α-Oxo-ketene Dienophiles. Organic letters, 2014, 16, 4126-4129 |
| 1517421 | CIF | C23 H21 N O3 S | P b c a | 6.387; 16.5721; 37.2128 90; 90; 90 | 3938.8 | Ma, Xueji; Pan, Shanfei; Wang, Hangxiang; Chen, Wanzhi Rhodium-Catalyzed Transannulation of N-Sulfonyl-1,2,3-triazoles and Epoxides: Regioselective Synthesis of Substituted 3,4-Dihydro-2H-1,4-oxazines. Organic letters, 2014, 16, 4554 |
| 1517491 | CIF | C13 H27 N5 O2 | P b c a | 12.6187; 15.3717; 15.8322 90; 90; 90 | 3070.99 | Polenz, I.; Laue, A.; Uhrin, T.; Rüffer, T.; Lang, H.; Schmidt, F. G.; Spange, S. Thermally cleavable imine base/isocyanate adducts and oligomers suitable as initiators for radical homo- and copolymerization Polym. Chem., 2014, 5, 6678 |
| 1517559 | CIF | C28 H16 F2 | P b c a | 10.498; 7.559; 23.466 90; 90; 90 | 1862.1 | Shen, Junjian; Yuan, Dafei; Qiao, Yan; Shen, Xingxing; Zhang, Zhongbo; Zhong, Yuwu; Yi, Yuanping; Zhu, Xiaozhang Diaceno[a,e]pentalenes from Homoannulations of o-Alkynylaryliodides Utilizing a Unique Pd(OAc)2/n-Bu4NOAc Catalytic Combination. Organic letters, 2014, 16, 4924-4927 |
| 1517649 | CIF | C16 H18 N2 O4 S Zn | P b c a | 16.739; 9.557; 20.295 90; 90; 90 | 3246.7 | Ying-Ying Liu; Jie Liu; Jin Yang; Bo Liu; Jian-Fang Ma Eight coordination compounds based on a reduced Schiff base tetraaminodiphenol macrocyclic ligand Inorganica Chimica Acta, 2013, 403, 85-96 |
| 1517668 | CIF | C22 H22 N2 O3 | P b c a | 9.00239; 14.4646; 27.9468 90; 90; 90 | 3639.12 | Drouhin, Pauline; Hurst, Timothy E.; Whitwood, Adrian C.; Taylor, Richard J. K. Copper-Mediated Construction of Spirocyclic Bis-oxindoles via a Double C-H, Ar-H Coupling Process. Organic letters, 2014, 16, 4900-4903 |
| 1517738 | CIF | C44 H50 N4 Zn | P b c a | 15.291; 15.0222; 32.525 90; 90; 90 | 7471.1 | Trinh, Cong; Kirlikovali, Kent; Das, Saptaparna; Ener, Maraia E.; Gray, Harry B.; Djurovich, Peter; Bradforth, Stephen E.; Thompson, Mark E. Symmetry-Breaking Charge Transfer of Visible Light Absorbing Systems: Zinc Dipyrrins. The journal of physical chemistry. C, Nanomaterials and interfaces, 2014, 118, 21834-21845 |
| 1517778 | CIF | C38 H33 Cl3 F3 Fe N4 O3 P Pd S | P b c a | 21.122; 18.0874; 21.51 90; 90; 90 | 8217.7 | Hong-Mei Li; Chen Xu; Xin-Qi Hao; Zhen Li; Zhi-Qiang Wang; Wei-Jun Fu; Mao-Ping Song Cationic cyclopalladated ferrocenylpyrimidine complex as an efficient catalyst for the synthesis of substituted biarylmethanol by the Suzuki reaction in water Inorganica Chimica Acta, 2013, 404, 236-240 |
| 1517806 | CIF | C34 H46 Cl2 N10 O2 Pt | P b c a | 10.5253; 17.2681; 20.8581 90; 90; 90 | 3791 | Gushchin, Pavel V.; Kuznetsov, Maxim L.; Haukka, Matti; Kukushkin, Vadim Yu Anionic halide···alcohol clusters in the solid state. The journal of physical chemistry. A, 2014, 118, 9529-9539 |
| 1517807 | CIF | C36 H50 Cl2 N10 O2 Pt | P b c a | 10.4214; 17.7041; 21.4018 90; 90; 90 | 3948.66 | Gushchin, Pavel V.; Kuznetsov, Maxim L.; Haukka, Matti; Kukushkin, Vadim Yu Anionic halide···alcohol clusters in the solid state. The journal of physical chemistry. A, 2014, 118, 9529-9539 |
| 1517810 | CIF | C40 H54 Cl2 N10 O4 Pt | P b c a | 10.7643; 17.784; 22.2899 90; 90; 90 | 4267.01 | Gushchin, Pavel V.; Kuznetsov, Maxim L.; Haukka, Matti; Kukushkin, Vadim Yu Anionic halide···alcohol clusters in the solid state. The journal of physical chemistry. A, 2014, 118, 9529-9539 |
| 1517851 | CIF | C23 H17 N O6 | P b c a | 21.073; 7.448; 23.393 90; 90; 90 | 3671.6 | Velasco, V.; Aguilà, D.; Barrios, L. A.; Borilovic, I.; Roubeau, O.; Ribas-Ariño, J.; Fumanal, M.; Teat, S. J.; Aromí, G. New coordination features; a bridging pyridine and the forced shortest non-covalent distance between two CO32−species Chem. Sci., 2015, 6, 123 |
| 1517885 | CIF | C24 H9 B F18 | P b c a | 15.56; 8.7136; 35.624 90; 90; 90 | 4830 | Zhang, Zuolun; Edkins, Robert M.; Nitsch, Jörn; Fucke, Katharina; Steffen, Andreas; Longobardi, Lauren E.; Stephan, Douglas W.; Lambert, Christoph; Marder, Todd B. Optical and electronic properties of air-stable organoboron compounds with strongly electron-accepting bis(fluoromesityl)boryl groups Chem. Sci., 2015, 6, 308 |
| 1517920 | CIF | C18 H14 B N | P b c a | 7.3708; 28.754; 12.9255 90; 90; 90 | 2739.4 | Sun, Feiye; Lv, Lily; Huang, Min; Zhou, Zhaohui; Fang, Xiangdong Palladium-catalyzed cross-coupling reactions of 4a,8a-azaboranaphthalene. Organic letters, 2014, 16, 5024-5027 |
| 1517923 | CIF | C20 H21 Br F N O2 S | P b c a | 18.6948; 7.70147; 26.3894 90; 90; 90 | 3799.48 | Romanov-Michailidis, Fedor; Pupier, Marion; Besnard, Céline; Bürgi, Thomas; Alexakis, Alexandre Enantioselective Catalytic Fluorinative Aza-semipinacol Rearrangement. Organic letters, 2014, 16, 4988-4991 |
| 1517949 | CIF | C30 H23 F N2 O | P b c a | 8.0593; 22.292; 25.202 90; 90; 90 | 4527.7 | Pusch, Stefan; Opatz, Till A photochemical one-pot three-component synthesis of tetrasubstituted imidazoles. Organic letters, 2014, 16, 5430-5433 |
| 1517964 | CIF | C36 H30 Cl4 Ni P2 | P b c a | 17.435; 15.662; 24.139 90; 90; 90 | 6592 | Hwang, Seung Jun; Powers, David C.; Maher, Andrew G.; Nocera, Daniel G. Tandem redox mediator/Ni(ii) trihalide complex photocycle for hydrogen evolution from HCl Chem. Sci., 2015, 6, 917 |
| 1517971 | CIF | C18 H15 Au Br N | P b c a | 15.9554; 11.7205; 16.839 90; 90; 90 | 3148.98 | Wu, Qian; Du, Chenglong; Huang, Yumin; Liu, Xingyan; Long, Zhen; Song, Feijie; You, Jingsong Stoichiometric to catalytic reactivity of the aryl cycloaurated species with arylboronic acids: insight into the mechanism of gold-catalyzed oxidative C(sp2)‒H arylation Chem. Sci., 2015, 6, 288 |
| 1518189 | CIF | C49 H66 O2 | P b c a | 10.7295; 25.4389; 32.8409 90; 90; 90 | 8963.8 | Zhang, Jinjin; Xiong, Jiao; Sun, Yangyang; Tang, Ning; Wu, Jincai Highly Iso-Selective and Active Catalysts of Sodium and Potassium Monophenoxides Capped by a Crown Ether for the Ring-Opening Polymerization ofrac-Lactide Macromolecules, 2014, 47, 7789 |
| 1518195 | CIF | C16 H19 N O3 | P b c a | 37.202; 8.9299; 9.4735 90; 90; 90 | 3147.2 | Li, Pan; Zhao, Jingjing; Xia, Chungu; Li, Fuwei Direct oxidative coupling of enamides and 1,3-dicarbonyl compounds: a facile and versatile approach to dihydrofurans, furans, pyrroles, and dicarbonyl enamides. Organic letters, 2014, 16, 5992-5995 |
| 1518289 | CIF | C32 H27 N | P b c a | 14.348; 16.969; 19.737 90; 90; 90 | 4805.4 | Gangadhararao, G.; Uruvakilli, Anasuyamma; Swamy, K. C. Kumara Brønsted Acid Mediated Alkenylation and Copper-Catalyzed Aerobic Oxidative Ring Expansion/Intramolecular Electrophilic Substitution of Indoles with Propargyl Alcohols: A Novel One-Pot Approach to Cyclopenta[c]quinolines. Organic letters, 2014, 16, 6060 |
| 1518315 | CIF | C29 H34 Cd N4 O5 | P b c a | 17.061; 14.6879; 22.0163 90; 90; 90 | 5517.1 | Ran, Yungen; Xie, Jixing; Mu, Yajuan; Zhang, Linfen; Han, Bo A series of 2D Cd(II) coordination polymers constructed from dicarboxylate acids and a flexible imidazole-based ligand Inorganica Chimica Acta, 2015, 425, 17-27 |
| 1518322 | CIF | C16 H17 N3 O2 | P b c a | 11.4611; 8.8278; 28.757 90; 90; 90 | 2909.5 | Mishra, Monika; Tiwari, Karishma; Singh, Ashish Kumar; Singh, Vinod P. Versatile coordination behaviour of a multi-dentate Schiff base with manganese(II), copper(II) and zinc(II) ions and their corrosion inhibition study Inorganica Chimica Acta, 2015, 425, 36-45 |
| 1518430 | CIF | C27 H24 O3 | P b c a | 16.33; 15.14; 17.416 90; 90; 90 | 4306 | Seetha Lakshmi, K. C.; Krishnan, Jagadeesh; Sinu, C. R.; Varughese, Sunil; Nair, Vijay N-heterocyclic carbene catalyzed annulation of enals to aurone analogs: synthesis of cyclopentene-fused spirobenzofuran-3-ones. Organic letters, 2014, 16, 6374-6377 |
| 1518447 | CIF | C67 F6 | P b c a | 9.9998; 20.6538; 31.3512 90; 90; 90 | 6475.1 | San, Long K.; Bukovsky, Eric V.; Larson, Bryon W.; Whitaker, James B.; Deng, S. H. M.; Kopidakis, Nikos; Rumbles, Garry; Popov, Alexey A.; Chen, Yu-Sheng; Wang, Xue-Bin; Boltalina, Olga V.; Strauss, Steven H. A faux hawk fullerene with PCBM-like properties Chem. Sci., 2015, 6, 1801 |
| 1518482 | CIF | C24 H20 N2 O | P b c a | 8.8127; 13.2298; 32.5 90; 90; 90 | 3789.2 | Fan, Zhoulong; Song, Shanshan; Li, Wei; Geng, Kaijun; Xu, Youjun; Miao, Ze-Hong; Zhang, Ao Rh(III)-Catalyzed Redox-Neutral C-H Activation of Pyrazolones: An Economical Approach for the Synthesis of N-Substituted Indoles. Organic letters, 2015, 17, 310-313 |
| 1518512 | CIF | C30 H35 N3 O Se Si | P b c a | 13.2692; 19.8926; 20.979 90; 90; 90 | 5537.6 | Vummaleti, Sai V. C.; Nelson, David J.; Poater, Albert; Gómez-Suárez, Adrián; Cordes, David B.; Slawin, Alexandra M. Z.; Nolan, Steven P.; Cavallo, Luigi What can NMR spectroscopy of selenoureas and phosphinidenes teach us about the π-accepting abilities of N-heterocyclic carbenes? Chem. Sci., 2015, 6, 1895 |
| 1518555 | CIF | C12 H26 F6 K O6 P | P b c a | 15.404; 15.758; 16.51 90; 90; 90 | 4007.6 | Mandai, Toshihiko; Yoshida, Kazuki; Tsuzuki, Seiji; Nozawa, Risa; Masu, Hyuma; Ueno, Kazuhide; Dokko, Kaoru; Watanabe, Masayoshi Effect of ionic size on solvate stability of glyme-based solvate ionic liquids. The journal of physical chemistry. B, 2015, 119, 1523-1534 |
| 1518587 | CIF | C56 H92 Cl2 Co2 I2 N4 P4 Ti2 | P b c a | 18.6991; 16.4217; 21.8753 90; 90; 90 | 6717.3 | Wu, Bing; Bezpalko, Mark W.; Foxman, Bruce M.; Thomas, Christine M. A heterobimetallic complex featuring a Ti‒Co multiple bond and its application to the reductive coupling of ketones to alkenes Chem. Sci., 2015, 6, 2044 |
| 1518718 | CIF | C18 H26 O4 Si | P b c a | 16.759; 7.4334; 30.141 90; 90; 90 | 3754.9 | Xu, Xinfang; Wang, Xiangbo; Zavalij, Peter Y.; Doyle, Michael P. Straightforward Access to the [3.2.2]Nonatriene Structural Framework via Intramolecular Cyclopropenation/Buchner Reaction/Cope Rearrangement Cascade. Organic letters, 2015, 17, 790-793 |
| 1518735 | CIF | C46 H34 N4 O4 | P b c a | 10.981; 16.009; 19.987 90; 90; 90 | 3513.6 | Nielsen, Christian Benedikt Orea; Sørensen, Henning Osholm; Kongsted, Jacob Comparison between Theoretically and Experimentally Determined Electronic Properties: Applications to Two-Photon Singlet Oxygen Sensitizers. The journal of physical chemistry. A, 2015, 119, 1906-1916 |
| 1518748 | CIF | C15 H11 Br N4 O2 | P b c a | 10.784; 9.6655; 28.858 90; 90; 90 | 3007.9 | Chen, Yunfeng; Nie, Gang; Zhang, Qi; Ma, Shan; Li, Huan; Hu, Qinquan Copper-Catalyzed [3 + 2] Cycloaddition/Oxidation Reactions between Nitro-olefins and Organic Azides: Highly Regioselective Synthesis of NO2-Substituted 1,2,3-Triazoles. Organic letters, 2015, 17, 1118-1121 |
| 1518770 | CIF | C20 H16 Cl4 N2 | P b c a | 11.2813; 14.1148; 24.5832 90; 90; 90 | 3914.5 | Zhan, Ming; Zhang, Shaoguang; Huang, Zhe; Xi, Zhenfeng Synthesis of α,α,α',α'-Tetrachloro-Δ(1)-bipyrrolines and 4,8-Dichloro-2,6-diazasemibuvallenes. Organic letters, 2015, 17, 1026-1029 |
| 1518908 | CIF | C59 H61 Si2 | P b c a | 34.006; 7.6167; 36.832 90; 90; 90 | 9540 | Sbargoud, Kamal; Mamada, Masashi; Marrot, Jérôme; Tokito, Shizuo; Yassar, Abderrahim; Frigoli, Michel Diindeno[1,2-b:2′,1′-n]perylene: a closed shell related Chichibabin's hydrocarbon, the synthesis, molecular packing, electronic and charge transport properties Chem. Sci., 2015, 6, 3402 |
| 1518941 | CIF | C14 H19 N O3 S | P b c a | 8.4818; 10.9461; 30.035 90; 90; 90 | 2788.5 | Druzhenko, Tetiana; Denisenko, Olexandr; Kheylik, Yuri; Zozulya, Sergey; Shishkina, Svitlana S.; Tolmachev, Andrei; Mykhailiuk, Pavel K. Design, Synthesis, and Characterization of SO2-Containing Azabicyclo[3.n.1]alkanes: Promising Building Blocks for Drug Discovery. Organic letters, 2015, 17, 1922-1925 |
| 1519006 | CIF | C2 H9 Al3 N O13 P3 | P b c a | 13.678; 10.318; 17.357 90; 90; 90 | 2449.6 | Soulard, M.; Patarin, J.; Marler, B. Synthesis and structure of Mu-10 : a novel microporous hydroxyaluminophosphate (CH3)2NH2.Al3P3O12OH closely related to AlPO4-EN3 Solid State Sciences, 1999, 1, 37-53 |
| 1519082 | CIF | C11 H24 Cl N5 Ni O7 | P b c a | 14.586; 14.973; 15.218 90; 90; 90 | 3323.6 | Sanzenbacher, Ralf; Sotofte, Inger; Springborg, Johan Nickel(II) Complexes with [2(4).3(1)]Adamanzane, 1,4,7,10-Tetraazabicyclo[5.5.3]pentadecane Acta Chemica Scandinavica, 1999, 53, 457-464 |
| 1519098 | CIF | Bi Nb O8 Te2 | P b c a | 5.6109; 8.1277; 31.205 90; 90; 90 | 1423.1 | S. Blanchandin; J.C. Champarnaud-Mesjard; P. Thomas; B. Frit Crystal structure of BiNbTe2O8 Solid State Sciences, 2000, 2, 223-228 |
| 1519147 | CIF | C16 H30 Cl2 N P Se Ti | P b c a | 8.813; 15.0422; 31.232 90; 90; 90 | 4140 | Bochmann, Manfred; Hursthouse, Michael B.; Coles, Simon J. C16H30Cl2NPSeTi Crystal Structure Report Archive, 1994, 1191 |
| 1519150 | CIF | C35 H66 Cl2 N2 P2 Se2 Ti | P b c a | 13.233; 17.2161; 35.163 90; 90; 90 | 8011 | Bochmann, Manfred; Coles, Simon J.; Hursthouse, Michael B. C28H58Cl2N2P2Se2Ti, C7H8 Crystal Structure Report Archive, 1994, 1196 |
| 1519177 | CIF | C24 H15 Cl Fe O2 | P b c a | 7.594; 15.177; 31.13 90; 90; 90 | 3588 | Butler, Ian R.; Coles, Simon J.; Hursthouse, Michael B. C25H15ClFeO2 Crystal Structure Report Archive, 1997, 1039 |
| 1519180 | CIF | C10 H8 Cl2 N4 | P b c a | 7.23; 15.594; 19.618 90; 90; 90 | 2211.8 | Blake, Alexander J.; Light, Mark E.; Hursthouse, Michael B. C10H8Cl2N4 Crystal Structure Report Archive, 1997, 1206 |
| 1519181 | CIF | C24 H15 Cl Fe O2 | P b c a | 7.594; 15.177; 31.134 90; 90; 90 | 3588 | Butler, Ian R.; Coles, Simon J.; Hursthouse, Michael B. C24H15ClFeO2 Crystal Structure Report Archive, 1997, 1016 |
| 1519183 | CIF | C24 H18 Fe | P b c a | 10.7966; 17.6155; 17.888 90; 90; 90 | 3402.1 | Butler, Ian. R.; Coles, Simon J.; Hursthouse, Michael B. C24H18Fe Crystal Structure Report Archive, 1997, 765 |
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