Crystallography Open Database
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Searching space group like 'C m c 21'
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
---|---|---|---|---|---|---|
2227753 | CIF HKL Paper | C21 H17 N O4 | C m c 21 | 34.296; 7.401; 6.623 90; 90; 90 | 1681.1 | Cui, Yue; Gao, Qian; Wang, Huan-Huan; Wang, Lin; Xie, Ya-Bo Dimethyl 4,4'-(pyridine-2,6-diyl)dibenzoate Acta Crystallographica Section E, 2010, 66, o2975 |
2230167 | CIF HKL Paper | Cd3 H14 N2 O16 S3 | C m c 21 | 18.906; 7.9483; 9.9809 90; 90; 90 | 1499.8 | Yin, Xin Diammonium tricadmium tris(sulfate) dihydroxide dihydrate Acta Crystallographica Section E, 2011, 67, i31 |
2232710 | CIF HKL Paper | C14 H18 N3 O P | C m c 21 | 15.501; 10.8569; 8.1579 90; 90; 90 | 1372.9 | Pourayoubi, Mehrdad; Yousefi, Mohammad; Eslami, Farnaz; Rheingold, Arnold L.; Chen, Chao <i>N</i>,<i>N</i>-Dimethyl-<i>N</i>',<i>N</i>''-diphenylphosphoric triamide Acta Crystallographica Section E, 2011, 67, o3220 |
2234060 | CIF Paper | C15 H28 Cd N4 O6 S3 | C m c 21 | 14.7568; 15.4378; 10.6383 90; 90; 90 | 2423.54 | Ramesh, V.; Rajarajan, K.; Kumar, K. Sendil; Subashini, A.; NizamMohideen, M. <i>catena</i>-Poly[ammonium (cadmium-tri-μ-thiocyanato-κ^4^<i>S</i>:<i>N</i>;κ^2^<i>N</i>:<i>S</i>)‒1,4,10,13,16-hexaoxacyclooctadecane (1/1)] Acta Crystallographica Section E, 2012, 68, m335-m336 |
2235281 | CIF HKL Paper | Mg13 Na7 Nd O48 P12 | C m c 21 | 10.301; 15.461; 23.384 90; 90; 90 | 3724.2 | Jerbi, Hasna; Hidouri, Mourad; Mongi, Ben Amara Na~7~Mg~13~Nd(PO~4~)~12~ Acta Crystallographica Section E, 2012, 68, i44 |
2236148 | CIF HKL Paper | C15 H11 N S | C m c 21 | 14.717; 10.631; 7.375 90; 90; 90 | 1153.9 | Umezono, Satoru; Okuno, Tsunehisa 10-(Prop-1-yn-1-yl)-10<i>H</i>-phenothiazine Acta Crystallographica Section E, 2012, 68, o2790 |
2237095 | CIF HKL Paper | C3 H6 Cl N3 O4 | C m c 21 | 6.6807; 10.4409; 9.9707 90; 90; 90 | 695.5 | Yan, Biao; Li, Hong-Ya; Zhao, Ning-Ning; Li, Jie; Ma, Hai-Xia 3,3-Dinitroazetidinium chloride Acta Crystallographica Section E, 2012, 68, o3376 |
2237516 | CIF HKL Paper | C3 H5 N3 O8 | C m c 21 | 14.046; 9.607; 5.903 90; 90; 90 | 796.6 | Breiner, Megan M.; Chavez, David E.; Parrish, Damon A. 2-Nitro-1,3-dinitrooxypropane Acta Crystallographica Section E, 2013, 69, o384 |
2238837 | CIF Paper | C16 H19 Mn N2 O4 S | C m c 21 | 13.8803; 8.3195; 15.9035 90; 90; 90 | 1836.49 | Suckert, Stefan; Jess, Inke; Näther, Christian Bis(acetylacetonato-κ^2^<i>O</i>,<i>O</i>')(pyridine-κ<i>N</i>)(thiocyanato-κ<i>N</i>)manganese(III): a redetermination using data from a single crystal Acta Crystallographica Section E, 2013, 69, m657 |
2240681 | CIF HKL Paper | C7 H9 N7 O4 | C m c 21 | 6.406; 14.96; 10.867 90; 90; 90 | 1041.4 | Sivajeyanthi, Palaniyappan; Balasubramani, Kasthuri; Jeevaraj, Muthaiah; Thanigaimani, Kaliyaperumal; Khalib, Nuridayanti Che; Razak, Ibrahim Abdul Crystal structure of 2,4-diamino-7-(hydroxymethyl)pteridin-1-ium nitrate Acta Crystallographica Section E, 2015, 71, o376-o377 |
2240906 | CIF HKL Paper | C16 H16 Ca O5 S | C m c 21 | 25.531; 9.5351; 6.933 90; 90; 90 | 1687.8 | Voronova, Anna S.; Petrusenko, Svitlana R.; Goreshnik, Evgeny Crystal structure of <i>catena-</i>poly[calcium-di-μ~3~-benzoato-κ^6^<i>O</i>,<i>O</i>':<i>O</i>-μ~2~-(dimethyl sulfoxide)-κ^2^<i>O</i>:<i>O</i>] Acta Crystallographica Section E, 2015, 71, 906-909 |
2242027 | CIF HKL Paper | C6 H10 As K N O4.5 | C m c 21 | 24.3426; 10.4266; 7.8315 90; 90; 90 | 1987.7 | Smith, Graham; Wermuth, Urs D. Crystal structures and hydrogen bonding in the isotypic series of hydrated alkali metal (K, Rb and Cs) complexes with 4-aminophenylarsonic acid Acta Crystallographica Section E, 2017, 73, 203-208 |
2242028 | CIF HKL Paper | C6 H10 As N O4.5 Rb | C m c 21 | 24.4783; 10.4577; 8.0978 90; 90; 90 | 2072.9 | Smith, Graham; Wermuth, Urs D. Crystal structures and hydrogen bonding in the isotypic series of hydrated alkali metal (K, Rb and Cs) complexes with 4-aminophenylarsonic acid Acta Crystallographica Section E, 2017, 73, 203-208 |
2242029 | CIF HKL Paper | C6 H10 As Cs N O4.5 | C m c 21 | 24.65; 10.4373; 8.3992 90; 90; 90 | 2160.9 | Smith, Graham; Wermuth, Urs D. Crystal structures and hydrogen bonding in the isotypic series of hydrated alkali metal (K, Rb and Cs) complexes with 4-aminophenylarsonic acid Acta Crystallographica Section E, 2017, 73, 203-208 |
2242297 | CIF HKL Paper | C6 H12 Cl N | C m c 21 | 9.1532; 8.7029; 8.7336 90; 90; 90 | 695.71 | Britvin, Sergey N.; Rumyantsev, Andrey M. The 7-azanorbornane nucleus of epibatidine: 7-azabicyclo[2.2.1]heptan-7-ium chloride Acta Crystallographica Section E, 2017, 73, 1385-1388 |
2243711 | CIF HKL Paper | H6 K2 Mg3 O16 S3 | C m c 21 | 17.8228; 7.4879; 9.7686 90; 90; 90 | 1303.7 | Weil, Matthias Redetermination of K~2~Mg~3~(OH)~2~(SO~4~)~3~(H~2~O)~2~ from single-crystal X-ray data revealing the correct hydrogen-atom positions Acta Crystallographica Section E, 2021, 77, 62-65 |
2300383 | CIF Paper | C356 H32 Y4 | C m c 21 | 11.22205; 34.8174; 11.22569 90; 90; 90 | 4386.13 | Maki, Sachiko; Nishibori, Eiji; Kawaguchi, Daisuke; Sakata, Makoto; Takata, Masaki; Inoue, Takashi; Shinohara, Hisanori Element-selective charge density visualization of endohedral metallofullerenes using synchrotron X-ray multi-wavelength anomalous powder diffraction data Journal of Applied Crystallography, 2013, 46, 649-655 |
2300529 | CIF | N2 O Si2 | C m c 21 | 8.847; 5.452; 4.824 90; 90; 90 | 232.68 | Srinivasa, S.R.; Jorgensen, J.D.; Cartz, L.; Worlton, T.G.; Beyerlein, R.A.; Billy, M. High-pressure neutron diffraction study of Si2 N2 O Journal of Applied Crystallography, 1977, 10, 167-171 |
2310023 | CIF | Ag Ca | C m c 21 | 4.08; 11.48; 4.65 90; 90; 90 | 217.799 | Dunsmore, R.S.; Calvert, L.D.; Tse, R.S.; Kuhi, L.V. The crystal structure of Ag Ca and Ag2 Ca Acta Crystallographica (1,1948-23,1967), 1957, 10, 775-775 |
2310612 | CIF | C Al4 O4 | C m c 21 | 5.76; 8.537; 9.121 90; 90; 90 | 448.508 | Jeffrey, G.A.; Slaughter, M. The structure of aluminium tetroxycarbide Acta Crystallographica (1,1948-23,1967), 1963, 16, 177-184 |
2310662 | CIF | Li2 O3 Si | C m c 21 | 9.36; 5.395; 4.675 90; 90; 90 | 236.074 | Seemann, H. Die Kristallstruktur des Lithiummetasilikates, (Li2 Si O3)x Acta Crystallographica (1,1948-23,1967), 1956, 9, 251-252 |
2310858 | CIF | Na2 O3 Si | C m c 21 | 10.43; 6.02; 4.81 90; 90; 90 | 302.013 | Grund, A.; Pizy, M.M. Structure Cristalline du Metasilicate de Sodium Anhydre, Na2 Si O3 Acta Crystallographica (1,1948-23,1967), 1952, 5, 837-840 |
2311108 | CIF Paper | C6 H10 K N2 O3.5 S | C m c 21 | 23.8174; 10.9141; 7.4645 90; 90; 90 | 1940.36 | How, Fiona N.-F.; Rahima, Z. A.; Khaledi, Hamid; Mohd Ali, Hapipah Dipotassium disulfanilamidate trihydrate. Acta crystallographica. Section E, Structure reports online, 2011, 67, m1071 |
2311496 | CIF | C12 H16 Bi Cl5 N6 O2 | C m c 21 | 19.4627; 13.8181; 7.7343 90; 90; 90 | 2080.04 | Boukoum, Chaima; Aloui, Zouhaier; Ferretti, Valeria; Abid, Sonia Synthesis, crystal structure and Hirshfeld surface analysis of a polymeric bis-muthate(III) halide complex, (C<sub>6</sub>H<sub>6</sub>N<sub>3</sub>)<sub>2</sub>[BiCl<sub>5</sub>]·2H<sub>2</sub>O. Acta crystallographica. Section E, Crystallographic communications, 2017, 73, 1759-1763 |
2311567 | CIF | C34 H28 N2 O4 | C m c 21 | 35.297; 9.3902; 8.3603 90; 90; 90 | 2771 | Ghichi, Nadir; Benboudiaf, Ali; DJebli, Yacine; Bensouici, Chawki; Merazig, Hocine Crystal structure, Hirshfeld surface analysis and anti-oxidant capacity of 2,2'-{(1<i>E</i>,1'<i>E</i>)-[1,2-phenyl-enebis(aza-nylyl-idene)]bis-(methanylyl-idene)}bis-(5-benz-yloxy)phenol. Acta crystallographica. Section E, Crystallographic communications, 2018, 74, 682-686 |
2312030 | CIF | Ca3 Mn2 O7 | C m c 21 | 19.46; 5.243; 5.239 90; 90; 90 | 534.529 | Beanland, R.; Smith, K.; Vaněk, P.; Zhang, H.; Hubert, A.; Evans, K.; Römer, R. A.; Kamba, S. A new electron diffraction approach for structure refinement applied to Ca~3~Mn~2~O~7~ Acta Crystallographica Section A, 2021, 77, 196-207 |
2312031 | CIF | Ca3 Mn2 O7 | C m c 21 | 19.435; 5.258; 5.247 90; 90; 90 | 536.187 | Beanland, R.; Smith, K.; Vaněk, P.; Zhang, H.; Hubert, A.; Evans, K.; Römer, R. A.; Kamba, S. A new electron diffraction approach for structure refinement applied to Ca~3~Mn~2~O~7~ Acta Crystallographica Section A, 2021, 77, 196-207 |
2312032 | CIF | Ca3 Mn2 O7 | C m c 21 | 19.425; 5.278; 5.259 90; 90; 90 | 539.18 | Beanland, R.; Smith, K.; Vaněk, P.; Zhang, H.; Hubert, A.; Evans, K.; Römer, R. A.; Kamba, S. A new electron diffraction approach for structure refinement applied to Ca~3~Mn~2~O~7~ Acta Crystallographica Section A, 2021, 77, 196-207 |
2312033 | CIF | Ca3 Mn2 O7 | C m c 21 | 19.44; 5.3; 5.275 90; 90; 90 | 543.494 | Beanland, R.; Smith, K.; Vaněk, P.; Zhang, H.; Hubert, A.; Evans, K.; Römer, R. A.; Kamba, S. A new electron diffraction approach for structure refinement applied to Ca~3~Mn~2~O~7~ Acta Crystallographica Section A, 2021, 77, 196-207 |
2312034 | CIF | Ca3 Mn2 O7 | C m c 21 | 19.455; 5.325; 5.29 90; 90; 90 | 548.033 | Beanland, R.; Smith, K.; Vaněk, P.; Zhang, H.; Hubert, A.; Evans, K.; Römer, R. A.; Kamba, S. A new electron diffraction approach for structure refinement applied to Ca~3~Mn~2~O~7~ Acta Crystallographica Section A, 2021, 77, 196-207 |
3000043 | On hold until 2015-07-13 | H12 N2 O14 U | C m c 21 | 13.1049; 7.8894; 11.3276 90; 90; 90 | 1171.16 | Rousselin; Meyer Conformational and structural studies of N-methylacetohydroxamic acid and of its mono- and dileptic uranium(VI) complexes To be published in Inorganic Chemistry |
3000046 | On hold until 2015-10-11 | C43 H44 B2 Cl2 F8 P2 | C m c 21 | 22.86; 11.7003; 15.6988 90; 90; 90 | 4198.9 | Stephanie Hurst To be published in Tetrahedron Letters |
3000243 | CIF | C Si | C m c 21 | 3.0778; 5.335; 15.1219 90; 90; 90 | 248.3 | El Mendili, Yassine; Orberger, Beate; Chateigner, Daniel; Bardeau, Jean-François; Gascoin, Stéphanie; Petit, Sébastien; Perez, Olivier; Khadraoui, Fouzia Insight into the structural, elastic and electronic properties of a new orthorhombic 6O-SiC polytype Scientific Reports, 2020, 10, 7562 |
3000399 | On hold until 2022-12-06 | Ga12 Rh4 | C m c 21 | 3.2116; 9.1666; 8.4581 90; 90; 90 | 249.002 | Wittkaemper, H.; Hock, R.; Weisser, M.; Dallmann, J.; Vogel, C.; Raman, N.; Tacardi, N.; Haumann, M.; Wasserscheid, P.; Hsieh, T.-E.; Maisel, S.; Moritz, M.; Wichmann, C.; Frisch, J.; Gorgoi, M.; Wilks, R. G.; Baer, M.; Wu, M.; Spiecker, E.; Goerling, A.; Unruh, T.; Steinrueck, H.-P.; Christian Papp To be published in Scientific Reports |
4000084 | CIF | C3 H10 Mn2 N2 Se2 | C m c 21 | 20.383; 6.719; 6.565 90; 90; 90 | 899.1 | Huang, Xiaoying; Heulings, IV, Harry R.; Le, Vina; Li, Jing Inorganic-Organic Hybrid Composites Containing MQ (II-VI) Slabs: A New Class of Nanostructures with Strong Quantum Confinement and Periodic Arrangement Chemistry of Materials, 2001, 13, 3754-3759 |
4000668 | CIF | Cs2 O14.59 P2 U V2 | C m c 21 | 20.7116; 6.8564; 10.5497 90; 90; 90 | 1498.13 | Chemistry of Materials, 2005 |
4000698 | CIF | C7 H14 Br N5 S2 | C m c 21 | 44.128; 10.789; 8.351 90; 90; 90 | 3975.9 | Keith Prout; Stephen J. Heyes; Christopher M. Dobson; Andrew McDaid; Thierry Maris; Matthias Muller; Matthew J. Seaman Variable-Temperature Studies of Order/Disorder Transitions in the Thiourea Pyridinium Halide Crystals by XRD and Solid-State 2H NMR Chemistry of Material, 2000, 12, 3561-3569 |
4000882 | CIF | Co3 H6 K2 O16 S3 | C m c 21 | 17.8638; 7.548; 9.7506 90; 90; 90 | 1314.73 | Vilminot, Serge; Baker, Peter J.; Blundell, Stephen J.; Sugano, Tadashi; André, Gilles; Kurmoo, Mohamedally Giant Magnetic Hardness in the Synthetic Mineral Ferrimagnet K2CoII3(OH)2(SO4)3(H2O)2 Chemistry of Materials, 2010, 22, 4090 |
4001000 | CIF | C51 H38 | C m c 21 | 22.474; 10.6415; 14.7196 90; 90; 90 | 3520.3 | Ye, Shanghui; Liu, Yunqi; Di, Chong-an; Xi, Hongxia; Wu, Weiping; Wen, Yugen; Lu, Kun; Du, Chunyan; Liu, Ying; Yu, Gui Wide-Energy-Gap Host Materials for Blue Phosphorescent Organic Light-Emitting Diodes Chemistry of Materials, 2009, 21, 1333 |
4001077 | CIF | O5 Pb3 Se | C m c 21 | 10.5211; 10.7151; 5.7452 90; 90; 90 | 647.68 | Kim, Sang-Hwan; Yeon, Jeongho; Halasyamani, P. Shiv Noncentrosymmetric Polar Oxide Material, Pb3SeO5: Synthesis, Characterization, Electronic Structure Calculations, and Structure−Property Relationships Chemistry of Materials, 2009, 21, 5335 |
4001128 | CIF | Co3 H10 Na2 O18 S3 | C m c 21 | 19.785; 7.2793; 9.9663 90; 90; 90 | 1435.4 | Zhang, Xian-Ming; Li, Cui-Rui; Zhang, Xu-Hui; Zhang, Wei-Xiong; Chen, Xiao-Ming Unusual Slow Magnetic Relaxation in Helical Co3(OH)2Ferrimagnetic Chain Based Cobalt Hydroxysulfates Chemistry of Materials, 2008, 20, 2298 |
4001129 | CIF | Co3 H12 O18 S3 | C m c 21 | 18.25; 7.5988; 9.813 90; 90; 90 | 1360.8 | Zhang, Xian-Ming; Li, Cui-Rui; Zhang, Xu-Hui; Zhang, Wei-Xiong; Chen, Xiao-Ming Unusual Slow Magnetic Relaxation in Helical Co3(OH)2Ferrimagnetic Chain Based Cobalt Hydroxysulfates Chemistry of Materials, 2008, 20, 2298 |
4001325 | CIF | Ag10 Br3 Te4 | C m c 21 | 15.4004; 15.6539; 13.6987 90; 90; 90 | 3302.4 | Lange, Stefan; Bawohl, Melanie; Wilmer, Dirk; Meyer, Hinrich-Wilhelm; Wiemhöfer, Hans-Dieter; Nilges, T. Polymorphism, Structural Frustration, and Electrical Properties of the Mixed Conductor Ag10Te4Br3 Chemistry of Materials, 2007, 19, 1401 |
4002918 | CIF | C22 H12 Cl2 N2 O2 S | C m c 21 | 6.57483; 18.364; 16.5153 90; 90; 90 | 1994.06 | Wiscons, Ren A.; Coropceanu, Veaceslav; Matzger, Adam J. Quaternary Charge-Transfer Solid Solutions: Electronic Tunability through Stoichiometry Chemistry of Materials, 2019, 31, 6598 |
4002974 | CIF | C22 H12 Br2 N2 O2 Se | C m c 21 | 6.64274; 18.4437; 16.9726 90; 90; 90 | 2079.43 | Wiscons, Ren A.; Coropceanu, Veaceslav; Matzger, Adam J. Quaternary Charge-Transfer Solid Solutions: Electronic Tunability through Stoichiometry Chemistry of Materials, 2019, 31, 6598 |
4002975 | CIF | C22 H12 Br2 N2 O2 S | C m c 21 | 6.6092; 18.3407; 16.8277 90; 90; 90 | 2039.81 | Wiscons, Ren A.; Coropceanu, Veaceslav; Matzger, Adam J. Quaternary Charge-Transfer Solid Solutions: Electronic Tunability through Stoichiometry Chemistry of Materials, 2019, 31, 6598 |
4003252 | CIF | C4 O24 Si12 | C m c 21 | 13.8553; 17.3992; 5.03855 90; 90; 90 | 1214.65 | Santoro, Mario; Scelta, Demetrio; Dziubek, Kamil; Ceppatelli, Matteo; Gorelli, Federico A.; Bini, Roberto; Garbarino, Gaston; Thibaud, Jean-Marc; Di Renzo, Francesco; Cambon, Olivier; Hermet, Patrick; Rouquette, Jerome; van der Lee, Arie; Haines, Julien Synthesis of 1D Polymer/Zeolite Nanocomposites under High Pressure Chemistry of Materials, 2016, 28, 4065 |
4003253 | CIF | C1.2 O25.2 Si12 | C m c 21 | 13.8867; 17.4429; 5.04748 90; 90; 90 | 1222.62 | Santoro, Mario; Scelta, Demetrio; Dziubek, Kamil; Ceppatelli, Matteo; Gorelli, Federico A.; Bini, Roberto; Garbarino, Gaston; Thibaud, Jean-Marc; Di Renzo, Francesco; Cambon, Olivier; Hermet, Patrick; Rouquette, Jerome; van der Lee, Arie; Haines, Julien Synthesis of 1D Polymer/Zeolite Nanocomposites under High Pressure Chemistry of Materials, 2016, 28, 4065 |
4003298 | CIF | C3 H10 Cl3 N Sn | C m c 21 | 9.598; 8.368; 12.416 90; 90; 90 | 997.2 | Dang, Yangyang; Zhong, Cheng; Zhang, Guodong; Ju, Dianxing; Wang, Lei; Xia, Shengqing; Xia, Haibing; Tao, Xutang Crystallographic Investigations into Properties of Acentric Hybrid Perovskite Single Crystals NH(CH3)3SnX3 (X = Cl, Br) Chemistry of Materials, 2016, 28, 6968 |
4003300 | CIF | C3 H10 Cl3 N Sn | C m c 21 | 9.476; 8.29; 12.34 90; 90; 90 | 969.4 | Dang, Yangyang; Zhong, Cheng; Zhang, Guodong; Ju, Dianxing; Wang, Lei; Xia, Shengqing; Xia, Haibing; Tao, Xutang Crystallographic Investigations into Properties of Acentric Hybrid Perovskite Single Crystals NH(CH3)3SnX3 (X = Cl, Br) Chemistry of Materials, 2016, 28, 6968 |
4003401 | CIF | C20 H1.25 I10 N6 Pb3 | C m c 21 | 54.188; 8.9661; 8.7984 90; 90; 90 | 4274.7 | Oswald, Iain W. H.; Koegel, Alexandra A.; Neilson, James R. General Synthesis Principles for Ruddlesden‒Popper Hybrid Perovskite Halides from a Dynamic Equilibrium Chemistry of Materials, 2018, 30, 8606 |
4003495 | CIF | B5 F3 O7 Pb | C m c 21 | 10.025; 8.764; 8.073 90; 90; 90 | 709.3 | Han, Shujuan; Mutailipu, Miriding; Tudi, Abudukadi; Yang, Zhihua; Pan, Shilie PbB5O7F3: A High-Performing Short-Wavelength Nonlinear Optical Material Chemistry of Materials, 2020 |
4003957 | CIF | Cs2 F5 I Mo O4 | C m c 21 | 12.2153; 10.4656; 7.856 90; 90; 90 | 1004.31 | Hu, Yilei; Jiang, Xingxing; Wu, Chao; Huang, Zhipeng; Lin, Zheshuai; Humphrey, Mark G.; Zhang, Chi A2MoO2F3(IO2F2) (A = Rb, Cs): Strong Nonlinear Optical Responses and Enlarged Band Gaps through Fluorine Incorporation Chemistry of Materials, 2021 |
4003958 | CIF | F5 I Mo O4 Rb2 | C m c 21 | 11.806; 10.1279; 7.6661 90; 90; 90 | 916.64 | Hu, Yilei; Jiang, Xingxing; Wu, Chao; Huang, Zhipeng; Lin, Zheshuai; Humphrey, Mark G.; Zhang, Chi A2MoO2F3(IO2F2) (A = Rb, Cs): Strong Nonlinear Optical Responses and Enlarged Band Gaps through Fluorine Incorporation Chemistry of Materials, 2021 |
4004024 | CIF | Bi5 Na Nb4 O18 | C m c 21 | 24.9258; 5.4638; 5.4927 90; 90; 90 | 748.05 | Kim, Kisung; Lee, Min Hyung; Ok, Kang Min Structural Origin of Very Large Second-Harmonic Generation of a Layered Perovskite, Na0.5Bi2.5Nb2O9 Chemistry of Materials, 2021, 33, 6564-6571 |
4023588 | CIF | C42 H58 F12 N2 O15 P2 | C m c 21 | 20.757; 10.663; 22.319 90; 90; 90 | 4940 | Chunlin He; Zuming Shi; Qizhong Zhou; Shijun Li; Ning Li; Feihe Huang Syntheses of cis- and trans-Dibenzo-30-Crown-10 Derivatives via Regioselective Routes and Their Complexations with Paraquat and Diquat Journal of Organic Chemistry, 2008, 73, 5872-5880 |
4026164 | CIF | C20 H20 B Cl N4 O2 | C m c 21 | 16.1669; 9.9131; 11.3102 90; 90; 90 | 1812.62 | Yuichi Hirano; Satoshi Kojima; Yohsuke Yamamoto A Hypervalent Pentacoordinate Boron Compound with an N-B-N Three-Center Four-Electron Bond Journal of Organic Chemistry, 2011, 76, 2123-2131 |
4030266 | CIF | Nb2 Pb1.14 S5.14 | C m c 21 | 3.3263; 5.776; 35.876 90; 90; 90 | 689.3 | Meerschaut, A.; Guemas, L.; Auriel, C.; Rouxel, J. Preparation, structure determination and transport properties of a new misfit layer compound : (PbS1.14)(NbS2)2 European Journal of Solid State and Inorganic Chemistry, 1990, 27, 557-570 |
4030500 | CIF | N3 Na Si2 | C m c 21 | 9.468; 5.502; 4.878 90; 90; 90 | 254.1 | Jacobs, H.; Mengis, H. Preparation and crystal structure of a sodium silicon nitride, NaSi2N3 European Journal of Solid State and Inorganic Chemistry, 1993, 30, 45-53 |
4031229 | CIF | Cl3 F3 N3 P3 | C m c 21 | 12.575; 9.654; 7.751 90; 90; 90 | 940.964 | Clare, P.; King, T.J.; Sowerby, D.B. Crystal Structures of cis-2,4,6-Trichloro- and cis-2,4,6-Tribromo-2,4,6-trifluorocyclotri(phosphazene) Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-), 1974, 1974, 2071-2074 |
4031230 | CIF | Br3 F3 N3 P3 | C m c 21 | 12.514; 10.144; 7.987 90; 90; 90 | 1013.89 | Clare, P.; King, T.J.; Sowerby, D.B. Crystal structures of cis-2,4,6-trichloro- and cis-2,4,6-tribromo-2,4,6-trifluorocyclotri(phosphazene ) Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-), 1974, 1974, 2071-2074 |
4034979 | CIF | C38 H45 Cs N8 O4 | C m c 21 | 17.237; 12.996; 16.538 90; 90; 90 | 3704.7 | Kim, Seung Hyeon; Lee, Juhoon; Vargas-Zúñiga, Gabriela I; Lynch, Vincent M.; Hay, Benjamin P.; Sessler, Jonathan L.; Kim, Sung Kuk Pyrrole- and Naphthobipyrrole-Strapped Calix[4]pyrroles as Azide Anion Receptors. The Journal of organic chemistry, 2018, 83, 2686-2693 |
4035466 | CIF | C34 H18 | C m c 21 | 26.3604; 9.2591; 8.1138 90; 90; 90 | 1980.36 | Liu, Shi; Roch, Loïc M; Allemann, Oliver; Xu, Jun; Vanthuyne, Nicolas; Baldridge, Kim K.; Siegel, Jay S. 1,2,3- versus 1,2-Indeno Ring Fusions Influence Structure Property and Chirality of Corannulene Bowls. The Journal of organic chemistry, 2018, 83, 3979-3986 |
4036804 | CIF | C25 H28 O2 P2 S6 | C m c 21 | 34.2; 11.86; 6.9 90; 90; 90 | 2799 | Hua, Guoxiong; Du, Junyi; Cordes, David B.; Slawin, Alexandra M. Z.; Woollins, J. Derek One-Pot Three-Component Condensation Synthesis and Structural Features of Organophosphorus-Sulfur Macrocycles. The Journal of organic chemistry, 2016, 81, 4210-4225 |
4060473 | CIF | C29 H43 B N2 Ti | C m c 21 | 19.2679; 10.2436; 13.7096 90; 90; 90 | 2705.9 | Vojtech Jancik; Leslie W. Pineda; A. Claudia Stückl; Herbert W. Roesky; Regine Herbst-Irmer Organometallics, 2005 |
4061896 | CIF | C18 H19 N2 O2 | C m c 21 | 30.742; 7.4158; 6.465 90; 90; 90 | 1473.86 | Organometallics, 2003 |
4063909 | CIF | C51 H41 Cl6 N2 O3 P2 Ru | C m c 21 | 14.854; 18.898; 17.153 90; 90; 90 | 4815 | Ghosh, Kaushik; Kumar, Sushil; Kumar, Rajan; Singh, Udai P.; Goel, Nidhi Photocleavage of Coordinated NO under Visible Light from Two Different Classes of Organometallic Ruthenium Nitrosyl Complexes: Reversible Binding of Phenolato Function Organometallics, 2011, 30, 2498 |
4064152 | CIF | C31 H27 Cl3 Fe3 | C m c 21 | 18.391; 20.224; 7.7205 90; 90; 90 | 2871.6 | Salmi, Mauro; Busetto, Luigi; Mazzoni, Rita; Zacchini, Stefano; Zanotti, Valerio New and Selective Routes to Functionalized Biferrocenes and Terferrocenes by [3 + 2] Cycloadditions of Alkynes with Bridging C3Ligands in Diiron Complexes Organometallics, 2011, 30, 1175 |
4066110 | CIF | C16 H18 Hg N2 | C m c 21 | 21.7105; 7.1769; 8.9718 90; 90; 90 | 1397.9 | Patel, Upali; Sharma, Sagar; Singh, Harkesh B.; Dey, Sandip; Jain, Vimal K.; Wolmershäuser, Gotthelf; Butcher, Ray J. Intermetallic Bonds in Metallophilic Mercuraazametallamacrocycles of Synthetic Design Organometallics, 2010, 29, 4265 |
4067354 | CIF | C18 H37 Ca I N4 | C m c 21 | 13.252; 11.3612; 15.6074 90; 90; 90 | 2349.8 | Langer, Jens; Görls, Helmar; Westerhausen, Matthias Stability and Reactivity of Phenylstrontium Compounds in Solution Organometallics, 2010, 29, 2034 |
4068763 | CIF | C13 H18 Cu F3 O3 S | C m c 21 | 11.345; 9.915; 13.767 90; 90; 90 | 1548.6 | Bellott, Brian J.; Girolami, Gregory S. Structures and Properties of Copper Alkene Complexes. Preorganization Effects and the Binding of Different Isomers of Cyclododecatriene to Copper Triflate Organometallics, 2009, 28, 2046 |
4069945 | CIF | C46 H72 Au2 P2 | C m c 21 | 21.8915; 21.9518; 17.8889 90; 90; 90 | 8596.7 | Gao, Lei; Peay, Miya A.; Partyka, David V.; Updegraff, James B.; Teets, Thomas S.; Esswein, Arthur J.; Zeller, Matthias; Hunter, Allen D.; Gray, Thomas G. Mono- and Di-Gold(I) Naphthalenes and Pyrenes: Syntheses, Crystal Structures, and Photophysics Organometallics, 2009, 28, 5669 |
4070370 | CIF | C17 H26 B Co F4 | C m c 21 | 9.1007; 14.7533; 13.0941 90; 90; 90 | 1758.1 | Ylijoki, Kai E. O.; Witherell, Ross D.; Kirk, Andrew D.; Böcklein, Sebastian; Lofstrand, Verner A.; McDonald, Robert; Ferguson, Michael J.; Stryker, Jeffrey M. Synthesis, Structure, and Reactivity of Alkyl-Substituted Half-Sandwich η5-Pentadienyl Complexes of Cobalt Organometallics, 2009, 28, 6807 |
4070859 | CIF | C16 H21 Cl O Ru | C m c 21 | 9.0438; 13.2365; 12.6151 90; 90; 90 | 1510.13 | Fairchild, Robert M.; Holman, K. Travis [(η5-C5Me4CH2R)Ru(η6-arene)]+and [(η5-C5Me4CH2R)Ru(CH3CN)3]+Compounds Possessing Pendant Arms Organometallics, 2008, 27, 1823 |
4070903 | CIF | C18 H14 Fe | C m c 21 | 15.06; 9.6563; 8.8505 90; 90; 90 | 1287.1 | Kirillov, Evgueni; Kahlal, Samia; Roisnel, Thierry; Georgelin, Thomas; Saillard, Jean-Yves; Carpentier, Jean-François Haptotropic Rearrangements in Sandwich (Fluorenyl)(Cyclopentadienyl) Iron and Ruthenium Complexes Organometallics, 2008, 27, 387 |
4073014 | CIF | C28 H32 Cl4 N2 Ru | C m c 21 | 18.071; 11.112; 14.124 90; 90; 90 | 2836.2 | Phillips, Andrew D.; Laurenczy, Gábor; Scopelliti, Rosario; Dyson, Paul J. Facile, Thermoreversible Cycloaddition of Small Molecules to a Ruthenium(II) Arene β-Diketiminate Organometallics, 2007, 26, 1120 |
4073584 | CIF | C18.5 H19 Cl3 O3 Zr2.5 | C m c 21 | 17.415; 19.118; 13.417 90; 90; 90 | 4467.1 | Hill, Anthony F.; Smith, Matthew K. Cyclooctatetraene Poly(azolyl)borate Complexes of Zirconium: [Zr(κ2-L)Cl(η-C8H8)] (L = H2B(pz)2, HB(pzMe2)3, H2B(mt)2; pz = Pyrazolyl, mt = Methimazolyl) Organometallics, 2007, 26, 3900 |
4075113 | CIF | C37 H70 B9 Mo N5 | C m c 21 | 14.867; 17.634; 17.202 90; 90; 90 | 4509.8 | Lei, Peng; McGrath, Thomas D.; Stone, F. Gordon A. Oxidation of the Bis-molybdenum(0) Trianion [1,3,6-{Mo(CO)3}-3,6-(μ-H)2-1,1,1-(CO)3-2-Ph-closo-1,2-MoCB9H7]3-: Metal and Boron Vertex Substitution and Cluster Expansion§ Organometallics, 2006, 25, 2011 |
4076170 | CIF | C54.5 H52 Cr N5 O1.38 | C m c 21 | 18.08; 17.14; 16.732 90; 90; 90 | 5185 | Crewdson, Patrick; Gambarotta, Sandro; Djoman, Marie-Charlotte; Korobkov, Ilia; Duchateau, Robbert Switchable Chromium(II) Ethylene Oligomerization/Polymerization Catalyst Organometallics, 2005, 24, 5214 |
4076180 | CIF | C21 H26 Ag Cl N2 | C m c 21 | 21.0382; 9.7005; 9.9477 90; 90; 90 | 2030.14 | de Frémont, Pierre; Scott, Natalie M.; Stevens, Edwin D.; Ramnial, Taramatee; Lightbody, Owen C.; Macdonald, Charles L. B.; Clyburne, Jason A. C.; Abernethy, Colin D.; Nolan, Steven P. Synthesis of Well-DefinedN-Heterocyclic Carbene Silver(I) Complexes Organometallics, 2005, 24, 6301 |
4078385 | CIF | C46 H39 Cl5 O3 P2 Pd | C m c 21 | 14.6048; 17.1715; 17.156 90; 90; 90 | 4302.5 | Vicente, José; Abad, José-Antonio; Rink, Barbara; Hernández, Francisco-Santos; Ramírez de Arellano, M. Carmen Synthesis of Mercury(II) and Palladium(II) Organometallic Derivatives of Terephthaldehyde by Metalation, Transmetalation, Oxidation, and Condensation Reactions. X-ray Crystal Structures oftrans-[PdCl{C6H3(CO2H)2-2,5}(PPh3)2]·Me2CO·2MeOH,trans-[PdCl{C6H3(CHO)-2-(CO2H)-5}(PPh3)2]·2CH2Cl2, and [Pd{C6H3(CHNC6H4NH2-4)-2-(CHO)-5}(N,N,N‘,N‘-Tetramethylethylenediamine)]CF3SO3. Molecular Assemblies through [Pd]−Cl···HO2C−Aryl and [Pd]−Cl···HOMe HO(O)C−Aryl Hydrogen Bonds† Organometallics, 1997, 16, 5269 |
4080078 | CIF | C17 H15 F6 Ir O | C m c 21 | 12.5662; 8.2197; 15.8285 90; 90; 90 | 1634.93 | Mak, Kar Hang Garvin; Chan, Pek Ke; Fan, Wai Yip; Ganguly, Rakesh; Leong, Weng Kee Photochemical Reaction of Cp*Ir(CO)2with C6F5X (X = CN, F): Formation of Diiridium(II) Complexes Organometallics, 2013, 32, 1053 |
4081092 | CIF | C84 H134 Bi3 Cl3 N6 Si3 | C m c 21 | 31.6302; 17.407; 16.7434 90; 90; 90 | 9218.7 | Day, Benjamin M.; Coles, Martyn P. Assigning Hapticity to Cyclopentadienyl Derivatives of Antimony and Bismuth Organometallics, 2013, 32, 4270 |
4082133 | CIF | C20 H49 B11 Na2 O4 | C m c 21 | 16.7451; 16.7451; 11.4298 90; 90; 90 | 3204.9 | Zhang, Jian; Zheng, Fangrui; Xie, Zuowei Synthesis and Characterization of 14-Vertex Carboranes Organometallics, 2013, 32, 7399 |
4087562 | CIF | C20 H34 F3 N P2 Pt | C m c 21 | 12.853; 13.165; 14.31 90; 90; 90 | 2421.4 | Wickramasinghe, Lasantha A.; Sharp, Paul R. Hydroxyl Radical Control through Hydrogen Bonding: Photolysis of Platinum(IV)hydroxido Complexes with Intramolecular H-Bonding Organometallics, 2015, 34, 3451 |
4100383 | CIF | C47 H71 N O3 Ti | C m c 21 | 18.38; 24.348; 10.254 90; 90; 90 | 4588.7 | Journal of the American Chemical Society, 2005 |
4100531 | CIF | C21 H33 Au3 F6 N3 P S | C m c 21 | 14.636; 25.02; 15.322 90; 90; 90 | 5611 | Gussenhoven, Emily M.; Fettinger, James C.; Pham, David M.; Malwitz, Mark A.; Balch, Alan L. A Reversible Polymorphic Phase Change Which Affects the Luminescence and Aurophilic Interactions in the Gold(I) Cluster Complex, [μ~3~-S(AuCNC~7~H~13~)~3~](SbF~6~) Journal of the American Chemical Society, 2005, 127, 10838-10839 |
4100532 | CIF | C24 H39 Au3 F6 N3 S Sb | C m c 21 | 15.1136; 26.613; 15.988 90; 90; 90 | 6430.7 | Gussenhoven, Emily M.; Fettinger, James C.; Pham, David M.; Malwitz, Mark A.; Balch, Alan L. A Reversible Polymorphic Phase Change Which Affects the Luminescence and Aurophilic Interactions in the Gold(I) Cluster Complex, [μ~3~-S(AuCNC~7~H~13~)~3~](SbF~6~) Journal of the American Chemical Society, 2005, 127, 10838-10839 |
4101806 | CIF | C10 H10 S2 Si | C m c 21 | 13.186; 12.994; 6.7057 90; 90; 90 | 1148.9 | Takeshi Ohmae; Tohru Nishinaga; Mo Wu; Masahiko Iyoda Cyclic Tetrathiophenes Planarized by Silicon and Sulfur Bridges Bearing Antiaromatic Cyclooctatetraene Core: Syntheses, Structures, and Properties Journal of the American Chemical Society, 2010, 132, 1066-1074 |
4102044 | CIF | C4.92 F0.82 N1.64 O48 Si24 | C m c 21 | 13.723; 17.458; 5.0756 90; 90; 90 | 1216 | Claudio M. Zicovich-Wilson; Felipe Gándara; Angeles Monge; Miguel A. Camblor In SituTransformation of TON Silica Zeolite into the Less Dense ITW: Structure-Direction Overcoming Framework Instability in the Synthesis of SiO2 Zeolites Journal of the American Chemical Society, 2010, 132, 3461-3471 |
4102194 | CIF | C31 H42 N4 Ni O3 | C m c 21 | 14.5313; 13.9827; 14.7422 90; 90; 90 | 2995.4 | Deguang Huang; R. H. Holm Reactions of the Terminal NiII-OH Group in Substitution and Electrophilic Reactions with Carbon Dioxide and Other Substrates: Structural Definition of Binding Modes in an Intramolecular NiII...FeII Bridged Site Journal of the American Chemical Society, 2010, 132, 4693-4701 |
4102208 | CIF | C31 H42 N4 O3 Pd | C m c 21 | 14.461; 13.742; 14.839 90; 90; 90 | 2948.9 | Deguang Huang; R. H. Holm Reactions of the Terminal NiII-OH Group in Substitution and Electrophilic Reactions with Carbon Dioxide and Other Substrates: Structural Definition of Binding Modes in an Intramolecular NiII...FeII Bridged Site Journal of the American Chemical Society, 2010, 132, 4693-4701 |
4103703 | CIF | Ba F4 Mn | C m c 21 | 4.237; 15.17; 6.0214 90; 90; 90 | 387 | Sun Woo Kim; Hong Young Chang; P. Shiv Halasyamani Selective Pure-Phase Synthesis of the Multiferroic BaMF4 (M = Mg, Mn, Co, Ni, and Zn) Family Journal of the American Chemical Society, 2010, 132, 17684-17685 |
4103704 | CIF | Ba Co F4 | C m c 21 | 4.2173; 14.6573; 5.8656 90; 90; 90 | 362.58 | Sun Woo Kim; Hong Young Chang; P. Shiv Halasyamani Selective Pure-Phase Synthesis of the Multiferroic BaMF4 (M = Mg, Mn, Co, Ni, and Zn) Family Journal of the American Chemical Society, 2010, 132, 17684-17685 |
4103705 | CIF | Ba F4 Ni | C m c 21 | 4.1591; 14.492; 5.8078 90; 90; 90 | 350.06 | Sun Woo Kim; Hong Young Chang; P. Shiv Halasyamani Selective Pure-Phase Synthesis of the Multiferroic BaMF4 (M = Mg, Mn, Co, Ni, and Zn) Family Journal of the American Chemical Society, 2010, 132, 17684-17685 |
4104761 | CIF | C32 H14 | C m c 21 | 26.018; 9.2556; 7.6909 90; 90; 90 | 1852.1 | Brian D. Steinberg; Edward A. Jackson; Alexander S. Filatov; Atsushi Wakamiya; Marina A. Petrukhina; Lawrence T. Scott Aromatic π-Systems More Curved Than C60. The Complete Family of All Indenocorannulenes Synthesized by Iterative Microwave-Assisted Intramolecular Arylations Journal of the American Chemical Society, 2009, 131, 10537-10545 |
4105442 | CIF | C12 H23 N2 P | C m c 21 | 10.9903; 12.2569; 10.5191 90; 90; 90 | 1417 | Kirsten Spannhoff; Nadine Kuhl; Gerald Kehr; Roland Fröhlich; Gerhard Erker Remarkable Product Diversity in the "Self-Organized" Reaction of Deprotonated Acetonitrile with Chlorophosphines Journal of the American Chemical Society, 2009, 131, 17836-17842 |
4105791 | CIF | Cr H12 N3 O8 | C m c 21 | 9.8893; 9.889; 8.0326 90; 90; 90 | 785.55 | Raghabendra Samantaray; Ronald J. Clark; Eun S. Choi; Haidong Zhou; Naresh S. Dalal M3-x(NH4)xCrO8 (M = Na, K, Rb, Cs): A New Family of Cr5±Based Magnetic Ferroelectrics Journal of the American Chemical Society, 2011, 133, 3792-3795 |
4106907 | CIF | C47 H51 Co N5 O0.5 S2 | C m c 21 | 16.2916; 18.644; 15.7275 90; 90; 90 | 4777.1 | Titel Jurca; Ahmed Farghal; Po-Heng Lin; Ilia Korobkov; Muralee Murugesu; Darrin S. Richeson Single-Molecule Magnet Behavior with a Single Metal Center Enhanced through Peripheral Ligand Modifications Journal of the American Chemical Society, 2011, 133, 15814-15817 |
4106961 | CIF | C32 H12 | C m c 21 | 17.7727; 12.6382; 8.1349 90; 90; 90 | 1827.22 | Tsun-Cheng Wu; Hsin-Ju Hsin; Ming-Yu Kuo; Ching-Hsiu Li; Yao-Ting Wu Synthesis and Structural Analysis of a Highly Curved Buckybowl Containing Corannulene and Sumanene Fragments Journal of the American Chemical Society, 2011, 133, 16319-16321 |
4107360 | CIF | C998.48 H1702.91 Ag2.48 B115.33 Br62.91 Cl8 Fe8 N32 O64 Si64 | C m c 21 | 37.028; 29.3262; 29.3677 90; 90; 90 | 31890 | Ming Fang; Scott R. Wilson; Kenneth S. Suslick A Four-Coordinate Fe(III) Porphyrin Cation Journal of the American Chemical Society, 2008, 130, 1134-1135 |
4108959 | CIF | C12 H28 N2 Pd | C m c 21 | 8.7968; 14.4109; 10.9609 90; 90; 90 | 1389.51 | John E. Bercaw; George S. Chen; Jay A. Labinger; Bo-Lin Lin Hydrogen Tunneling in Protonolysis of Platinum(II) and Palladium(II) Methyl Complexes: Mechanistic Implications Journal of the American Chemical Society, 2008, 130, 17654-17655 |
4108994 | CIF | C53.5 H24 | C m c 21 | 16.19; 27.376; 14.093 90; 90; 90 | 6246 | Edward A. Jackson; Brian D. Steinberg; Mihail Bancu; Atsushi Wakamiya; Lawrence T. Scott Pentaindenocorannulene and Tetraindenocorannulene: New Aromatic Hydrocarbon π Systems with Curvatures Surpassing That of C60 Journal of the American Chemical Society, 2007, 129, 484-485 |
4109105 | CIF | C33 H29 N9 O4 | C m c 21 | 37.074; 9.0221; 9.3593 90; 90; 90 | 3130.5 | Iwao Okamoto; Mayumi Nabeta; Yasuko Hayakawa; Nobuyoshi Morita; Tetsuya Takeya; Hyuma Masu; Isao Azumaya; Osamu Tamura Acid-Induced Molecular Folding and Unfolding of N-Methyl Aromatic Amide Bearing 2,6-Disubstituted Pyridines Journal of the American Chemical Society, 2007, 129, 1892-1893 |
4109270 | CIF | Cd Sb2 Yb2 | C m c 21 | 4.6184; 17.418; 7.178 90; 90; 90 | 577.4 | Sheng-qing Xia; Svilen Bobev Cation-Anion Interactions as Structure Directing Factors: Structure and Bonding of Ca2CdSb2 and Yb2CdSb2 Journal of the American Chemical Society, 2007, 129, 4049-4057 |
4110050 | CIF | C46 H36 Cl6 P2 Pt | C m c 21 | 16.14097; 16.8563; 15.227 90; 90; 90 | 4142.92 | Laura Bini; Christian Müller; Jos Wilting; Lars von Chrzanowski; Anthony L. Spek; Dieter Vogt Highly Selective Hydrocyanation of Butadiene toward 3-Pentenenitrile Journal of the American Chemical Society, 2007, 129, 12622-12623 |
4111319 | CIF | C38 H39 Cl4 N2 O2 Rh | C m c 21 | 23.6307; 9.7837; 17.1251 90; 90; 90 | 3959.2 | Matthew D. Sanderson; Justin W. Kamplain; Christopher W. Bielawski Quinone-Annulated N-Heterocyclic Carbene-Transition-Metal Complexes: Observation of π-Backbonding Using FT-IR Spectroscopy and Cyclic Voltammetry Journal of the American Chemical Society, 2006, 128, 16514-16515 |
4111973 | CIF | C15 H27 Mo O4 P Ru S3 | C m c 21 | 9.449; 16.93; 13.252 90; 90; 90 | 2120 | Bunsho Kure; Seiji Ogo; Daisuke Inoki; Hidetaka Nakai; Kiyoshi Isobe; Shunichi Fukuzumi Synthesis and Crystal Structure of an Open Capsule-Type Octanuclear Heterometallic Sulfide Cluster with a Linked Incomplete Double Cubane Framework without an Intramolecular Inversion Center Journal of the American Chemical Society, 2005, 127, 14366-14374 |
4112785 | CIF | H63 K6 Mo12 O60 P3 S12 | C m c 21 | 11.1863; 26.3305; 29.6214 90; 90; 90 | 8724.71 | Emmanuel Cadot; Marie-José Pouet; Chantal Robert-Labarre; Charlotte du Peloux; Jérôme Marrot; Francis Sécheresse Polyphosphate Ions Encapsulated in Oxothiomolybdate Rings: Synthesis, Structure, and Behavior in Solution Journal of the American Chemical Society, 2004, 126, 9127-9134 |
4113036 | CIF | C39 H48 Cu8 N16 | C m c 21 | 20.76; 10.8497; 21.0042 90; 90; 90 | 4731 | Xiao-Chun Huang; Jie-Peng Zhang; Xiao-Ming Chen A New Route to Supramolecular Isomers via Molecular Templating: Nanosized Molecular Polygons of Copper(I) 2-Methylimidazolates Journal of the American Chemical Society, 2004, 126, 13218-13219 |
4113038 | CIF | C38 H46 Cu8 N16 | C m c 21 | 20.8478; 10.8591; 20.9398 90; 90; 90 | 4740.5 | Xiao-Chun Huang; Jie-Peng Zhang; Xiao-Ming Chen A New Route to Supramolecular Isomers via Molecular Templating: Nanosized Molecular Polygons of Copper(I) 2-Methylimidazolates Journal of the American Chemical Society, 2004, 126, 13218-13219 |
4113039 | CIF | C38 H52 Cu8 N16 | C m c 21 | 20.8445; 10.8978; 20.9081 90; 90; 90 | 4749.5 | Xiao-Chun Huang; Jie-Peng Zhang; Xiao-Ming Chen A New Route to Supramolecular Isomers via Molecular Templating: Nanosized Molecular Polygons of Copper(I) 2-Methylimidazolates Journal of the American Chemical Society, 2004, 126, 13218-13219 |
4113122 | CIF | C36 H98 N6 O58 W12 | C m c 21 | 22.9618; 14.7301; 22.6265 90; 90; 90 | 7653 | De-Liang Long; Hamera Abbas; Paul Kögerler; Leroy Cronin A High-Nuclearity "Celtic-Ring" Isopolyoxotungstate, [H12W36O120]12-, That Captures Trace Potassium Ions Journal of the American Chemical Society, 2004, 126, 13880-13881 |
4113465 | CIF | C12 H37 F7 Ga9 N4 O40.5 P9 Rb2 | C m c 21 | 32.151; 17.229; 10.212 90; 90; 90 | 5656.73 | Lionel Beitone; Jérôme Marrot; Thierry Loiseau; Gérard Férey; Marc Henry; Clarisse Huguenard; Axel Gansmuller; Francis Taulelle MIL-50, an Open-Framework GaPO with a Periodic Pattern of Small Water Ponds and Dry Rubidium Atoms: a Combined XRD, NMR, and Computational Study Journal of the American Chemical Society, 2003, 125, 1912-1922 |
4113797 | CIF | C3 H10 Cd2 N2 Se2 | C m c 21 | 20.666; 6.89; 6.7513 90; 90; 90 | 961.31 | Xiaoying Huang; Jing Li; Yong Zhang; Angelo Mascarenhas From 1D Chain to 3D Network: Tuning Hybrid II-VI Nanostructures and Their Optical Properties Journal of the American Chemical Society, 2003, 125, 7049-7055 |
4114225 | CIF | C53 H54 Cl2 O12 P2 | C m c 21 | 19.827; 12.558; 21.186 90; 90; 90 | 5275 | Michele Suman; Micol Freddi; Chiara Massera; Franco Ugozzoli; Enrico Dalcanale Rational Design of Cavitand Receptors for Mass Sensors Journal of the American Chemical Society, 2003, 125, 12068-12069 |
4114355 | CIF | C75 H158 Ge27 K6 N4 O36 | C m c 21 | 15.187; 37.638; 23.04 90; 90; 90 | 13170 | Angel Ugrinov; Slavi C. Sevov Derivatization of Deltahedral Zintl Ions by Nucleophilic Addition: [Ph-Ge9-SbPh2]2-and [Ph2Sb-Ge9-Ge9-SbPh2]4- Journal of the American Chemical Society, 2003, 125, 14059-14064 |
4114911 | CIF | H3.2 O18.6 Rb2 Si6 V2 | C m c 21 | 15.614; 8.36; 13.142 90; 90; 90 | 1715.5 | Xiqu Wang; Lumei Liu; Allan J. Jacobson Open-Framework and Microporous Vanadium Silicates Journal of the American Chemical Society, 2002, 124, 7812-7820 |
4115520 | CIF | C15 H32 N6 O8 S2 | C m c 21 | 7.5013; 20.576; 15.796 90; 90; 90 | 2438.1 | K. Travis Holman; Stephen M. Martin; Daniel P. Parker; Michael D. Ward The Generality of Architectural Isomerism in Designer Inclusion Frameworks Journal of the American Chemical Society, 2001, 123, 4421-4431 |
4116159 | CIF | C20 H26 Al2 N2 | C m c 21 | 22.448; 10.029; 9.4089 90; 90; 90 | 2118.2 | Zhengkun Yu; Joanne M. Wittbrodt; Mary Jane Heeg; H. Bernhard Schlegel; Charles H. Winter Unusually Stable Pyrazolate-Bridged Dialuminum Complexes Containing Bridging Methyl Groups Journal of the American Chemical Society, 2000, 122, 9338-9339 |
4116212 | CIF | C10 H32 Mo10 O33 Rb4 S10 | C m c 21 | 24.296; 10.165; 21.828 90; 90; 90 | 5391 | Bernadette Salignac; Sandra Riedel; Anne Dolbecq; Francis Sécheresse; Emmanuel Cadot "Wheeling Templates" in Molecular Oxothiomolybdate Rings: Syntheses, Structures, and Dynamics Journal of the American Chemical Society, 2000, 122, 10381-10389 |
4116808 | CIF | C30 H54 B8 W3 | C m c 21 | 17.8507; 14.1146; 13.7229 90; 90; 90 | 3457.6 | Andrew S. Weller; Maoyu Shang; Thomas P. Fehlner Synthesis and Structure of the Metallaborane Cp*3(μ-H)W3B8H8 from the Thermolysis of Cp*H3WB4H8 (Cp* = η5-C5Me5). A Close-Packed 11-Atom Boron-Rich Cluster Journal of the American Chemical Society, 1998, 120, 8283-8284 |
4117701 | CIF | C68 H44 F12 Mo2 N13 O14 S4 | C m c 21 | 14.9441; 22.035; 22.0108 90; 90; 90 | 7248 | Eric J. Sundstrom; Xinzheng Yang; V. Sara Thoi; Hemamala I. Karunadasa; Christopher J. Chang; Jeffrey R. Long; Martin Head-Gordon Computational and Experimental Study of the Mechanism of Hydrogen Generation from Water by a Molecular Molybdenum-Oxo Electrocatalyst Journal of the American Chemical Society, 2012, 134, 5233-5242 |
4117781 | CIF | Ba23 Ga8 S38 Sb2 | C m c 21 | 9.611; 32.246; 12.883 90; 90; 90 | 3993 | Mei-Chun Chen; Li-Ming Wu; Hua Lin; Liu-Jiang Zhou; Ling Chen Disconnection Enhances the Second Harmonic Generation Response: Synthesis and Characterization of Ba23Ga8Sb2S38 Journal of the American Chemical Society, 2012, 134, 6058-6060 |
4118100 | CIF | C6 F N2 O S4 | C m c 21 | 6.301; 7.921; 15.916 90; 90; 90 | 794.4 | Aaron Mailman; Stephen M. Winter; Xin Yu; Craig M. Robertson; Wenjun Yong; John S. Tse; Richard A. Secco; Zhenxian Liu; Paul A. Dube; Judith A. K. Howard; Richard T. Oakley Crossing the Insulator-to-Metal Barrier with a Thiazyl Radical Conductor Journal of the American Chemical Society, 2012, 134, 9886-9889 |
4118668 | CIF | Cr H12 N3 O8 | C m c 21 | 9.8893; 9.889; 8.0326 90; 90; 90 | 785.55 | Raghabendra Samantaray; Ronald J. Clark; Eun S. Choi; Naresh S. Dalal Elucidating the Mechanism of Multiferroicity in (NH4)3Cr(O2)4 and Its Tailoring by Alkali Metal Substitution Journal of the American Chemical Society, 2012, 134, 15953-15962 |
4118960 | CIF | C36 H56 I2 N24 O22 | C m c 21 | 19.3748; 16.0589; 16.0249 90; 90; 90 | 4986 | Hamdy S. El-Sheshtawy; Bassem S. Bassil; Khaleel I. Assaf; Ulrich Kortz; Werner M. Nau Halogen Bonding inside a Molecular Container Journal of the American Chemical Society, 2012, 134, 19935-19941 |
4119492 | CIF | B11 Ba4 F O20 | C m c 21 | 18.8112; 10.7151; 8.6031 90; 90; 90 | 1734.1 | Hongping Wu; Hongwei Yu; Zhihua Yang; Xueling Hou; Xin Su; Shilie Pan; Kenneth R. Poeppelmeier; James M. Rondinelli Designing a Deep-Ultraviolet Nonlinear Optical Material with a Large Second Harmonic Generation Response Journal of the American Chemical Society, 2013, 135, 4215-4218 |
4120248 | CIF | Ag0.93 Ca0.91 La0.09 Sb | C m c 21 | 4.7028; 8.146; 7.7921 90; 90; 90 | 298.51 | Jian Wang; Xiao-Cun Liu; Sheng-Qing Xia; Xu-Tang Tao Ca1-xRExAg1-ySb (RE = La, Ce, Pr, Nd, Sm; 0 <=x<=1; 0 <=y<=1): Interesting Structural Transformation and Enhanced High-Temperature Thermoelectric Performance Journal of the American Chemical Society, 2013, 135, 11840-11848 |
4120329 | CIF | C6 H18 B10 F2 | C m c 21 | 10.358; 10.9827; 12.1927 90; 90; 90 | 1387.03 | Zaozao Qiu; Yangjian Quan; Zuowei Xie Palladium-Catalyzed Selective Fluorination of o-Carboranes Journal of the American Chemical Society, 2013, 135, 12192-12195 |
4120491 | CIF | B9 Cs3 O21 Zn6 | C m c 21 | 8.4268; 19.2101; 14.5611 90; 90; 90 | 2357.1 | Yu, Hongwei; Wu, Hongping; Pan, Shilie; Yang, Zhihua; Hou, Xueling; Su, Xin; Jing, Qun; Poeppelmeier, Kenneth R.; Rondinelli, James M. Cs3Zn6B9O21: A Chemically Benign Member of the KBBF Family Exhibiting the Largest Second Harmonic Generation Response. Journal of the American Chemical Society, 2014, 136, 1264-1267 |
4121251 | CIF | C37 H46 Fe N4 | C m c 21 | 25.8165; 15.5331; 7.8898 90; 90; 90 | 3163.89 | Burgert Blom; Gengwen Tan; Stephan Enthaler; Shigeyoshi Inoue; Jan Dirk Epping; Matthias Driess Bis-N-Heterocyclic Carbene (NHC) Stabilized η6-Arene Iron(0) Complexes: Synthesis, Structure, Reactivity, and Catalytic Activity Journal of the American Chemical Society, 2013, 135, 18108-18120 |
4121924 | CIF | C12 H42 Mo P4 Si | C m c 21 | 13.8563; 13.5078; 12.344 90; 90; 90 | 2310.4 | Zuzek, Ashley A.; Parkin, Gerard Si-H and Si-C Bond Cleavage Reactions of Silane and Phenylsilanes with Mo(PMe3)6: Silyl, Hypervalent Silyl, Silane, and Disilane Complexes. Journal of the American Chemical Society, 2014, 136, 8177-8180 |
4122287 | CIF | C104 H96 F36 N16 P6 | C m c 21 | 18.1424; 28.4624; 21.3281 90; 90; 90 | 11013.3 | Dale, Edward J.; Vermeulen, Nicolaas A.; Thomas, Andy A.; Barnes, Jonathan C.; Juríček, Michal; Blackburn, Anthea K.; Strutt, Nathan L.; Sarjeant, Amy A.; Stern, Charlotte L.; Denmark, Scott E.; Stoddart, J. Fraser ExCage Journal of the American Chemical Society, 2014, 136, 10669 |
4125556 | CIF | C38 H35 F4 Fe N2 O2 P | C m c 21 | 16.7064; 13.0153; 15.7175 90; 90; 90 | 3417.6 | Liu, Jian; Hu, Lianrui; Wang, Lei; Chen, Hui; Deng, Liang An Iron(II) Ylide Complex as A Masked Open-Shell Iron Alkylidene Species in Its Alkylidene-Transfer Reactions with Alkenes. Journal of the American Chemical Society, 2017 |
4125781 | CIF | C6 N2 O2 S4 | C m c 21 | 6.3278; 7.8999; 15.744 90; 90; 90 | 787 | Mailman, Aaron; Leitch, Alicea A.; Yong, Wenjun; Steven, Eden; Winter, Stephen M.; Claridge, Robert C. M.; Assoud, Abdeljalil; Tse, John S.; Desgreniers, Serge; Secco, Richard A.; Oakley, Richard T. The Power of Packing: Metallization of an Organic Semiconductor. Journal of the American Chemical Society, 2017, 139, 2180-2183 |
4126154 | CIF | C30.44 H68.49 Mn4.39 N8 O1.17 | C m c 21 | 17.2315; 12.7392; 19.4043 90; 90; 90 | 4259.5 | Vaddypally, Shivaiah; Kondaveeti, Sandeep K.; Karki, Santosh; Van Vliet, Megan M.; Levis, Robert J.; Zdilla, Michael J. Reactive Pendant Mn═O in a Synthetic Structural Model of a Proposed S4 State in the Photosynthetic Oxygen Evolving Complex. Journal of the American Chemical Society, 2017, 139, 4675-4681 |
4127751 | CIF | C12 H40 I10 N4 Pb3 | C m c 21 | 51.236; 8.7266; 9.1242 90; 90; 90 | 4079.6 | Han, Shiguo; Liu, Xitao; Liu, Yi; Xu, Zhiyun; Li, Yaobin; Hong, Maochun; Luo, Junhua; Sun, Zhihua High-Temperature Antiferroelectric of Lead Iodide Hybrid Perovskites. Journal of the American Chemical Society, 2019, 141, 12470-12474 |
4128207 | CIF | C9 H30 Br7 N3 Pb2 | C m c 21 | 39.1358; 8.3463; 8.1804 90; 90; 90 | 2672.04 | Li, Lina; Liu, Xitao; Li, Yaobin; Xu, Zhiyun; Wu, Zhenyue; Han, Shiguo; Tao, Kewen; Hong, Maochun; Luo, Junhua; Sun, Zhihua Two-Dimensional Hybrid Perovskite-Type Ferroelectric for Highly Polarization-Sensitive Shortwave Photodetection. Journal of the American Chemical Society, 2019, 141, 2623-2629 |
4129078 | CIF | C14 H18 Cl4 F2 N2 Pb | C m c 21 | 33.6194; 7.8738; 7.6832 90; 90; 90 | 2033.84 | Shi, Ping-Ping; Lu, Si-Qi; Song, Xian-Jiang; Chen, Xiao-Gang; Liao, Wei-Qiang; Li, Peng-Fei; Tang, Yuan-Yuan; Xiong, Ren-Gen Two-dimensional Organic-Inorganic Perovskite Ferroelectric Semiconductor with the Fluorinated Aromatic Spacers. Journal of the American Chemical Society, 2019 |
4129555 | CIF | C6 F N2 O S4 | C m c 21 | 5.5224; 7.5058; 15.155 90; 90; 90 | 628.2 | Tian, Di; Winter, Stephen M.; Mailman, Aaron; Wong, Joanne W. L.; Yong, Wenjun; Yamaguchi, Hiroshi; Jia, Yating; Tse, John S.; Desgreniers, Serge; Secco, Richard A.; Julian, Stephen R.; Jin, Changqing; Mito, Masaki; Ohishi, Yasuo; Oakley, Richard T. The metallic state in neutral radical conductors: dimensionality, pressure and multiple orbital effects. Journal of the American Chemical Society, 2015, 137, 14136-14148 |
4129556 | CIF | C6 F N2 O S4 | C m c 21 | 5.90617; 7.7074; 15.4587 90; 90; 90 | 703.7 | Tian, Di; Winter, Stephen M.; Mailman, Aaron; Wong, Joanne W. L.; Yong, Wenjun; Yamaguchi, Hiroshi; Jia, Yating; Tse, John S.; Desgreniers, Serge; Secco, Richard A.; Julian, Stephen R.; Jin, Changqing; Mito, Masaki; Ohishi, Yasuo; Oakley, Richard T. The metallic state in neutral radical conductors: dimensionality, pressure and multiple orbital effects. Journal of the American Chemical Society, 2015, 137, 14136-14148 |
4129561 | CIF | C6 F N2 O S4 | C m c 21 | 6.20057; 7.8636; 15.7606 90; 90; 90 | 768.47 | Tian, Di; Winter, Stephen M.; Mailman, Aaron; Wong, Joanne W. L.; Yong, Wenjun; Yamaguchi, Hiroshi; Jia, Yating; Tse, John S.; Desgreniers, Serge; Secco, Richard A.; Julian, Stephen R.; Jin, Changqing; Mito, Masaki; Ohishi, Yasuo; Oakley, Richard T. The metallic state in neutral radical conductors: dimensionality, pressure and multiple orbital effects. Journal of the American Chemical Society, 2015, 137, 14136-14148 |
4129562 | CIF | C6 F N2 O S4 | C m c 21 | 5.74052; 7.6003; 15.2757 90; 90; 90 | 666.47 | Tian, Di; Winter, Stephen M.; Mailman, Aaron; Wong, Joanne W. L.; Yong, Wenjun; Yamaguchi, Hiroshi; Jia, Yating; Tse, John S.; Desgreniers, Serge; Secco, Richard A.; Julian, Stephen R.; Jin, Changqing; Mito, Masaki; Ohishi, Yasuo; Oakley, Richard T. The metallic state in neutral radical conductors: dimensionality, pressure and multiple orbital effects. Journal of the American Chemical Society, 2015, 137, 14136-14148 |
4129563 | CIF | C6 F N2 O S4 | C m c 21 | 5.79339; 7.6413; 15.345 90; 90; 90 | 679.31 | Tian, Di; Winter, Stephen M.; Mailman, Aaron; Wong, Joanne W. L.; Yong, Wenjun; Yamaguchi, Hiroshi; Jia, Yating; Tse, John S.; Desgreniers, Serge; Secco, Richard A.; Julian, Stephen R.; Jin, Changqing; Mito, Masaki; Ohishi, Yasuo; Oakley, Richard T. The metallic state in neutral radical conductors: dimensionality, pressure and multiple orbital effects. Journal of the American Chemical Society, 2015, 137, 14136-14148 |
4129564 | CIF | C6 F N2 O S4 | C m c 21 | 5.6811; 7.5876; 15.249 90; 90; 90 | 657.3 | Tian, Di; Winter, Stephen M.; Mailman, Aaron; Wong, Joanne W. L.; Yong, Wenjun; Yamaguchi, Hiroshi; Jia, Yating; Tse, John S.; Desgreniers, Serge; Secco, Richard A.; Julian, Stephen R.; Jin, Changqing; Mito, Masaki; Ohishi, Yasuo; Oakley, Richard T. The metallic state in neutral radical conductors: dimensionality, pressure and multiple orbital effects. Journal of the American Chemical Society, 2015, 137, 14136-14148 |
4129565 | CIF | C6 F N2 O S4 | C m c 21 | 6.02602; 7.7738; 15.5993 90; 90; 90 | 730.75 | Tian, Di; Winter, Stephen M.; Mailman, Aaron; Wong, Joanne W. L.; Yong, Wenjun; Yamaguchi, Hiroshi; Jia, Yating; Tse, John S.; Desgreniers, Serge; Secco, Richard A.; Julian, Stephen R.; Jin, Changqing; Mito, Masaki; Ohishi, Yasuo; Oakley, Richard T. The metallic state in neutral radical conductors: dimensionality, pressure and multiple orbital effects. Journal of the American Chemical Society, 2015, 137, 14136-14148 |
4129569 | CIF | C4 H8 Cl3 Mn N | C m c 21 | 7.361; 17.49; 6.466 90; 90; 90 | 832.5 | Ye, Heng-Yun; Zhou, QiongHua; Niu, XiangHong; Liao, Wei-Qiang; Fu, Da-Wei; Zhang, Yi; You, Yu-Meng; Wang, Jinlan; Chen, Zhong-Ning; Xiong, Ren-Gen High-Temperature Ferroelectricity and Photoluminescence in a Hybrid Organic-Inorganic Compound: (3-Pyrrolinium)MnCl3. Journal of the American Chemical Society, 2015, 137, 13148-13154 |
4129809 | CIF | C6 I8 N2 O2 Pb3 S2 | C m c 21 | 4.5914; 27.2463; 26.7574 90; 90; 90 | 3347.31 | Guo, Yunlong; Shoyama, Kazutaka; Sato, Wataru; Matsuo, Yutaka; Inoue, Kento; Harano, Koji; Liu, Chao; Tanaka, Hideyuki; Nakamura, Eiichi Chemical Pathways Connecting Lead(II) Iodide and Perovskite via Polymeric Plumbate(II) Fiber. Journal of the American Chemical Society, 2015, 137, 15907-15914 |
4129813 | CIF | C6 I8 N2 O2 Pb3 S2 | C m c 21 | 4.6216; 27.455; 26.933 90; 90; 90 | 3417.4 | Guo, Yunlong; Shoyama, Kazutaka; Sato, Wataru; Matsuo, Yutaka; Inoue, Kento; Harano, Koji; Liu, Chao; Tanaka, Hideyuki; Nakamura, Eiichi Chemical Pathways Connecting Lead(II) Iodide and Perovskite via Polymeric Plumbate(II) Fiber. Journal of the American Chemical Society, 2015, 137, 15907-15914 |
4130491 | CIF | C24 H72 Pd4 Sb8 | C m c 21 | 18.4966; 13.0377; 19.9791 90; 90; 90 | 4818.02 | Benjamin, Sophie L.; Krämer, Tobias; Levason, William; Light, Mark E.; Macgregor, Stuart A.; Reid, Gillian [Pd4(μ3-SbMe3)4(SbMe3)4]: A Pd(0) Tetrahedron with μ3-Bridging Trimethylantimony Ligands. Journal of the American Chemical Society, 2016, 138, 6964-6967 |
4131920 | CIF | C8 H24 Ca Ga2 | C m c 21 | 7.388; 19.802; 9.63 90; 90; 90 | 1408.8 | Wolf, Benjamin M.; Stuhl, Christoph; Maichle-Mössmer, Cäcilia; Anwander, Reiner Dimethylcalcium. Journal of the American Chemical Society, 2018, 140, 2373-2383 |
4132445 | CIF | C9 H29 Br7 N4 Pb2 | C m c 21 | 38.91; 8.4458; 8.342 90; 90; 90 | 2741.4 | Li, Lina; Shang, Xiaoying; Wang, Sasa; Dong, Ningning; Ji, Chengmin; Chen, Xueyuan; Zhao, Sangen; Wang, Jun; Sun, Zhihua; Hong, Maochun; Luo, Junhua Bilayered Hybrid Perovskite Ferroelectric with Giant Two-Photon Absorption. Journal of the American Chemical Society, 2018, 140, 6806-6809 |
4133869 | CIF | C8 H32 Cl10 N4 Pb3 | C m c 21 | 45.5393; 8.1051; 8.0343 90; 90; 90 | 2965.46 | Wang, Sasa; Li, Lina; Weng, Wen; Ji, Chengmin; Liu, Xitao; Sun, Zhihua; Lin, Wenxiong; Hong, Maochun; Luo, Junhua Trilayered Lead Chloride Perovskite Ferroelectric Affording Self-Powered Visible-Blind Ultraviolet Photodetection with Large Zero-Bias Photocurrent. Journal of the American Chemical Society, 2019 |
4133889 | CIF | C10 H24 Br4 N2 O2 Pb | C m c 21 | 26.972; 8.9027; 7.9566 90; 90; 90 | 1910.6 | Chen, Xiao-Gang; Song, Xian-Jiang; Zhang, Zhi-Xu; Li, Peng-Fei; Ge, Jia-Zhen; Tang, Yuan-Yuan; Gao, Ji-Xing; Zhang, Wan-Ying; Fu, Da-Wei; You, Yu-Meng; Xiong, Ren-Gen Two-dimensional layered perovskite ferroelectric with giant piezoelectric voltage coefficient. Journal of the American Chemical Society, 2019 |
4133890 | CIF | C10 H24 Br4 N2 O2 Pb | C m c 21 | 26.89; 8.8834; 8.0708 90; 90; 90 | 1927.9 | Chen, Xiao-Gang; Song, Xian-Jiang; Zhang, Zhi-Xu; Li, Peng-Fei; Ge, Jia-Zhen; Tang, Yuan-Yuan; Gao, Ji-Xing; Zhang, Wan-Ying; Fu, Da-Wei; You, Yu-Meng; Xiong, Ren-Gen Two-dimensional layered perovskite ferroelectric with giant piezoelectric voltage coefficient. Journal of the American Chemical Society, 2019 |
4134107 | CIF | C10 H36 Br10 N4 Sn3 | C m c 21 | 51.021; 8.3783; 8.2874 90; 90; 90 | 3542.6 | Li, Lina; Liu, Xitao; He, Chao; Wang, Sasa; Ji, Chengmin; Zhang, Xinyuan; Sun, Zhihua; Zhao, Sangen; Hong, Maochun; Luo, Junhua A Potential Sn-Based Hybrid Perovskite Ferroelectric Semiconductor. Journal of the American Chemical Society, 2020, 142, 1159-1163 |
4134198 | CIF | C12 H40 I10 N4 Pb3 | C m c 21 | 52.0158; 8.9727; 8.9745 90; 90; 90 | 4188.6 | Fu, Yongping; Jiang, Xinyi; Li, Xiaotong; Traore, Boubacar; Spanopoulos, Ioannis; Katan, Claudine; Even, Jacky; Kanatzidis, Mercouri G.; Harel, Elad Cation Engineering in Two-Dimensional Ruddlesden-Popper Lead Iodide Perovskites with Mixed Large A-Site Cations in the Cages. Journal of the American Chemical Society, 2020, 142, 4008-4021 |
4134654 | CIF | C148 H307 N20 O138.5 Zn6 | C m c 21 | 28.526; 24.457; 30.314 90; 90; 90 | 21149 | Chen, Xu-Lang; Shen, Yun-Jia; Gao, Chao; Yang, Jian; Sun, Xin; Zhang, Xin; Yang, Yu-Dong; Wei, Gong-Ping; Xiang, Jun-Feng; Sessler, Jonathan L.; Gong, Han-Yuan Regulating the Structures of Self-Assembled Mechanically Interlocked Moleculecular Constructs via Dianion Precursor Substituent Effects. Journal of the American Chemical Society, 2020 |
4134928 | CIF | C21 H15 N3 | C m c 21 | 19.1389; 10.964; 7.0851 90; 90; 90 | 1486.73 | Torresi, Stefano; Famulari, Antonino; Marti-Rujas, Javier Kinetically controlled fast crystallization of M12L8 poly-[n]-catenanes using the 2,4,6-tris(4-pyridyl)benzene ligand and ZnCl2 in aromatic environment. Journal of the American Chemical Society, 2020 |
4134992 | CIF | C12 H24 F4 I4 N2 Pb | C m c 21 | 8.5418; 26.836; 10.0432 90; 90; 90 | 2302.2 | Chen, Xiao-Gang; Song, Xian-Jiang; Zhang, Zhi-Xu; Zhang, Han-Yue; Pan, Qiang; Yao, Jie; You, Yu-Meng; Xiong, Ren-Gen Confinement-Driven Ferroelectricity in a Two-Dimensional Hybrid Lead Iodide Perovskite. Journal of the American Chemical Society, 2020, 142, 10212-10218 |
4135112 | CIF | C17 H16 N4 O2 | C m c 21 | 28.055; 7.0673; 7.8774 90; 90; 90 | 1561.88 | Faghani, Abbas; Gholami, Mohammad Fardin; Trunk, Matthias; Müller, Johannes; Pachfule, Pradip; Vogl, Sarah; Donskyi, Ievgen; Nickl, Philip; Shao, Jingjing; Huang, Michael R. S.; Unger, Wolfgang E. S.; Arenal, Raul; Koch, Christoph T.; Paulus, Beate; Rabe, Jürgen P; Thomas, Arne; Haag, Rainer; Adeli, Mohsen Metal-Assisted and Solvent-Mediated Synthesis of Two-Dimensional Triazine Structures on Gram Scale. Journal of the American Chemical Society, 2020 |
4300417 | CIF | C7 H17 Co N O11 | C m c 21 | 11.725; 15.846; 6.978 90; 90; 90 | 1296.5 | Yi-Long Lu; Jing-Yun Wu; Ming-Che Chan; Sheng-Ming Huang; Chia-Shiang Lin; Te-Wei Chiu; Yen-Hsiang Liu; Yuh-Sheng Wen; Chuen-Her Ueng; Tsung-Mei Chin; Chen-Hsiung Hung; Kuang-Lieh Lu Influence of water content on the self-assembly of metal-organic frameworks based on pyridine-3,5-dicarboxylate Inorganic Chemistry, 2006 |
4301324 | CIF | C8 H11 N4 Np O5 | C m c 21 | 15.6132; 10.5746; 7.9019 90; 90; 90 | 1304.63 | Grigory B. Andreev; Nina A. Budantseva; Ivan G. Tananaev; Boris F. Myasoedov Interaction of Transuranium Elements with Biologically Important Molecules: Structural and Spectroscopic Study of Np(V) Complexes with Imidazole Inorganic Chemistry, 2009, 48, 1232-1235 |
4301762 | CIF | C18 H26 I2 O2 Pd3 S2 | C m c 21 | 7.7483; 17.074; 17.804 90; 90; 90 | 2355.4 | Frank L. Mulligan; Dominic C. Babbini; Isaac R. Davis; Stephanie K. Hurst; Gary S. Nichol Monomers and Polymers of Tripalladium(0) Ditropylium Halides Inorganic Chemistry, 2009, 48, 2708-2710 |
4303050 | CIF | Cs4 F K3 O20 Si4 U3 | C m c 21 | 7.8095; 22.2819; 14.0861 90; 90; 90 | 2451.13 | Cheng-Shiuan Lee; Sue-Lein Wang; Yen-Hung Chen; Kwang-Hwa Lii Flux Synthesis of Salt-Inclusion Uranyl Silicates: [K3Cs4F][(UO2)3(Si2O7)2] and [NaRb6F][(UO2)3(Si2O7)2] Inorganic Chemistry, 2009, 48, 8357-8361 |
4303794 | CIF | C14 H29 B9 Fe | C m c 21 | 12.8721; 10.2948; 13.4603 90; 90; 90 | 1783.7 | B. Štíbr; M. Bakardjiev; Josef Holub; Aleš Růžička; Magdalena Kvíčalová Systematic Method for the Incorporation of the {(η6-Arene)Fe} Fragment into Carborane Cages via [(η6-Arene)Fe]2+ Dications. A Series of [3-(η6-Arene)-closo-3,1,2-FeC2B9H11] Complexes. Reliable Synthesis of Polymethylated [(η6-Arene)2Fe]2+ Cations Inorganic Chemistry, 2009, 48, 10904-10906 |
4305633 | CIF | Ba2 In13 Ir4 | C m c 21 | 4.4856; 29.052; 13.687 90; 90; 90 | 1783.6 | Andriy M. Palasyuk; John D. Corbett BaIrIn4 and Ba2Ir4In13: Two In-Rich Polar Intermetallic Structures with Different Augmented Prismatic Environments about the Cations Inorganic Chemistry, 2008, 47, 9344-9350 |
4309399 | CIF | C32 H64 Br2 Cl2 N8 Ni2 O9 | C m c 21 | 23.3664; 18.7097; 20.0991 90; 90; 90 | 8786.9 | Konrad T. Szacilowski; Puhui Xie; Aramice Y. S. Malkhasian; Mary Jane Heeg; Manawadevi Y. Udugala-Ganehenege; Lowell E. Wenger; John F. Endicott Solid-State Structures and Magnetic Properties of Halide-Bridged, Face-to-Face Bis-Nickel(II)-Macrocyclic Ligand Complexes: Ligand-Mediated Interchanges of Electronic Configuration Inorganic Chemistry, 2005, 44, 6019-6033 |
4309915 | CIF HKL | Ba Fe2 O4 | C m c 21 | 8.4538; 19.04; 5.3826 90; 90; 90 | 866.4 | Pavel Karen; Emmanuelle Suard; François Fauth Crystal Structure of Stoichiometric YBa2Fe3O8 Inorganic Chemistry, 2005, 44, 8170-8172 |
4310866 | CIF | Cs2 O14 P4 Pd3 | C m c 21 | 7.6061; 14.282; 14.184 90; 90; 90 | 1540.81 | Kwang-Hwa Lii; Sue-Lein Wang; Fen-Ling Liao Cs2Pd3(P2O7)2 and Cs2Pd3(As2O7)2: A 3D Palladium Phosphate with a Tunnel Structure and a 2D Palladium Arsenate Containing Strings of Palladium Atoms Inorganic Chemistry, 2004, 43, 2499-2502 |
4311594 | CIF | Au2 O10 Se3 | C m c 21 | 16.891; 6.3013; 8.3266 90; 90; 90 | 886.2 | Mathias S. Wickleder; Oliver Büchner; Claudia Wickleder; Sherif el Sheik; Gunther Brunklaus; Hellmut Eckert Au2(SeO3)2(SeO4): Synthesis and Characterization of a New Noncentrosymmetric Selenite-Selenate Inorganic Chemistry, 2004, 43, 5860-5864 |
4313130 | CIF | C49 H30 Ge3 O12 Ru5 | C m c 21 | 20.5433; 13.8799; 18.5911 90; 90; 90 | 5301 | Richard D. Adams; Burjor Captain; Wei Fu Germanium-Rich Pentaruthenium Carbonyl Clusters Including Ru5(CO)11(μ-GePh2)4(μ5-C) and Its Reactions with Hydrogen Inorganic Chemistry, 2003, 42, 1328-1333 |
4315014 | CIF | C14 H8 Na0.5 O5 Yb0.5 | C m c 21 | 26.6753; 15.5727; 7.1782 90; 90; 90 | 2981.9 | You-Wen Lin; Bo-Ren Jian; Sin-Chiang Huang; Chin-Her Huang; Kuei-Fang Hsu Synthesis and Characterization of Three Ytterbium Coordination Polymers Featuring Various Cationic Species and a Luminescence Study of a Terbium Analogue With Open Channels Inorganic Chemistry, 2010, 49, 2316-2324 |
4315015 | CIF | C14 H8 Na0.5 O5 Tb0.5 | C m c 21 | 26.9201; 15.1196; 7.2696 90; 90; 90 | 2958.9 | You-Wen Lin; Bo-Ren Jian; Sin-Chiang Huang; Chin-Her Huang; Kuei-Fang Hsu Synthesis and Characterization of Three Ytterbium Coordination Polymers Featuring Various Cationic Species and a Luminescence Study of a Terbium Analogue With Open Channels Inorganic Chemistry, 2010, 49, 2316-2324 |
4315016 | CIF | C14 H8 Na0.5 O5 Yb0.5 | C m c 21 | 26.6753; 15.5727; 7.1782 90; 90; 90 | 2981.9 | You-Wen Lin; Bo-Ren Jian; Sin-Chiang Huang; Chin-Her Huang; Kuei-Fang Hsu Synthesis and Characterization of Three Ytterbium Coordination Polymers Featuring Various Cationic Species and a Luminescence Study of a Terbium Analogue With Open Channels Inorganic Chemistry, 2010, 49, 2316-2324 |
4315129 | CIF | C6 H13 Ga3 O13 P4 | C m c 21 | 37.99; 10.022; 8.3093 90; 90; 90 | 3163.6 | Martin P. Attfield; Zhanhui Yuan; Howard G. Harvey; William Clegg Structural Variety within Gallium Diphosphonates Affected by the Organic Linker Length Inorganic Chemistry, 2010, 49, 2656-2666 |
4315247 | CIF | C32 H39 B2 Cl N8 O3 Zn | C m c 21 | 21.534; 20.3912; 8.1228 90; 90; 90 | 3566.8 | Elena V. Mutseneck; Susanne Bieller; Michael Bolte; Hans-Wolfram Lerner; Matthias Wagner Fourth Generation Scorpionates: Coordination Behavior of a New Class of Conformationally Flexible Mixed-Donor (Pyrazol-1-yl)borates Inorganic Chemistry, 2010, 49, 3540-3552 |
4316709 | CIF | C12 H13 Cd3 Cl N16 | C m c 21 | 10.3417; 33.579; 13.4148 90; 90; 90 | 4658.5 | Gang Wei; Yu-Feng Shen; Yong-Ru Li; Xiao-Chun Huang Synthesis, Crystal Structure, and Photoluminescent Properties of Ternary Cd(II)/Triazolate/Chloride System Inorganic Chemistry, 2010, 49, 9191-9199 |
4316780 | CIF | C72 H68 Li2 O7 | C m c 21 | 17.0504; 24.7463; 15.1602 90; 90; 90 | 6396.6 | Yong Huang; Yueh-Hsuan Tsai; Wen-Chou Hung; Chieh-Shen Lin; Wei Wang; Jui-Hsien Huang; Saikat Dutta; Chu-Chieh Lin Synthesis and Structural Studies of Lithium and Sodium Complexes with OOO-Tridentate Bis(phenolate) Ligands: Effective Catalysts for the Ring-Opening Polymerization of l-Lactide Inorganic Chemistry, 2010, 49, 9416-9425 |
4317041 | CIF | Au3 In5 Yb2 | C m c 21 | 4.5351; 26.824; 7.4641 90; 90; 90 | 908 | C. Peter Sebastian; James Salvador; Joshua B. Martin; Mercouri G. Kanatzidis New Intermetallics YbAu2In4 and Yb2Au3In5 Inorganic Chemistry, 2010, 49, 10468-10474 |
4317896 | CIF | As3 Ba2 In K | C m c 21 | 10.129; 25.208; 13.884 90; 90; 90 | 3545 | Franck Gascoin; Slavi C. Sevov KBa2InAs3 with Coexisting Monomers of [In2As7]13- and Their One-Dimensional Polymers Inorganic Chemistry, 2002, 41, 2292-2295 |
4317940 | CIF | C18 H22 B N6 O3 Re S2 | C m c 21 | 29.462; 14.386; 17.546 90; 90; 90 | 7436.7 | Raquel Garcia; Ângela Domingos; António Paulo; Isabel Santos; Roger Alberto Reactivity of [Re{κ3-H(μ-H)B(timMe)2}(CO)3] (timMe= 2-Mercapto-1-methylimidazolyl) toward Neutral Substrates Inorganic Chemistry, 2002, 41, 2422-2428 |
4318135 | CIF | C35.5 H51 Cl2 Fe N4 S2 | C m c 21 | 23.565; 14.253; 22.849 90; 90; 90 | 7674 | Ming Li; Didier Bonnet; Eckhard Bill; Frank Neese; Thomas Weyhermüller; Nicole Blum; Dieter Sellmann; Karl Wieghardt Tuning the Electronic Structure of Octahedral Iron Complexes [FeL(X)] (L=1-Alkyl-4,7-bis(4-tert-butyl-2-mercaptobenzyl)- 1,4,7-triazacyclononane, X = Cl, CH3O, CN, NO). The S=1/2 \λeftarrow →S=3/2 Spin Equilibrium of [FeLPr(NO)] Inorganic Chemistry, 2002, 41, 3444-3456 |
4319423 | CIF | C4.5 H10 N2 | C m c 21 | 9.5806; 11.3247; 9.9447 90; 90; 90 | 1079 | Wolfgang Fraenk; Tassilo Habereder; Anton Hammerl; Thomas M. Klapötke; Burkhard Krumm; Peter Mayer; Heinrich Nöth; Marcus Warchhold Highly Energetic Tetraazidoborate Anion and Boron Triazide Adducts Inorganic Chemistry, 2001, 40, 1334-1340 |
4319907 | CIF | C60 H72 Cl16 Na3 O27 Ru2 | C m c 21 | 21.6069; 15.769; 24.4792 90; 90; 90 | 8340.5 | Hitoshi Miyasaka; Ho-Chol Chang; Katsunori Mochizuki; Susumu Kitagawa Syntheses, Structures, and Physicochemical Properties of Diruthenium Compounds of Tetrachlorocatecholate with Metal-Metal Bonded Ru3+(μ-OR)2Ru3+ and Ru3.5+(μ-OR)2Ru3.5+ Cores (R = CH3 and C2H5) Inorganic Chemistry, 2001, 40, 3544-3554 |
4319988 | CIF | C20 H22 Co N5 O | C m c 21 | 16.1983; 12.2557; 8.8952 90; 90; 90 | 1765.89 | Katherine J. Franz; Linda H. Doerrer; Bernhard Spingler; Stephen J. Lippard Pentacoordinate Cobalt(III) Thiolate and Nitrosyl Tropocoronand Compounds Inorganic Chemistry, 2001, 40, 3774-3780 |
4320093 | CIF | C3 H6 F14 O Sb2 | C m c 21 | 9.293; 12.456; 11.548 90; 90; 90 | 1336.7 | Rolf Minkwitz; Stefan Reinemann; Raphael Seelbinder; Detlef Konikowski; Hans Hartl; Irene Brüdgam; Joachim Hegge; Berthold Hoge; Jeffrey A. Sheehy; Karl O. Christe Synthesis and Characterization of the First Examples of Perfluoroalkyl-Substituted Trialkyloxonium Salts, [(CH3)2OCF3]+[Sb2F11]- and [(CH3)2OCF(CF3)2]+[Sb2F11]- Inorganic Chemistry, 2001, 40, 4404-4408 |
4320375 | CIF | C20 H31 Cl Cu F6 N5 O3 P | C m c 21 | 15.8165; 13.1367; 12.9107 90; 90; 90 | 2682.5 | Oshio, Hiroki; Yamamoto, Masashi; Ito, Tasuku; Kawauchi, Hidekazu; Koga, Nobuaki; Ikoma, Tadaaki; Tero-Kubota, Shozo Experimental and Theoretical Studies on Ferromagnetically Coupled Metal Complexes with Imino Nitroxides Inorganic Chemistry, 2001, 40, 5518-5525 |
4320918 | CIF | C11 H20 Cd N4 Se3 | C m c 21 | 9.9389; 16.8687; 11.0549 90; 90; 90 | 1853.42 | Hong Zhang; David E. Zelmon; Gary E. Price; Boon K. Teo Wide Spectral Range Nonlinear Optical Crystals of One-Dimensional Coordination Solids [Et4N][Cd(SCN)3] and [Et4N][Cd(SeCN)3] and the General Design Criteria for [R4N][Cd(XCN)3] (Where R = Alkyl and X = S, Se, Te) as NLO Crystals Inorganic Chemistry, 2000, 39, 1868-1873 |
4320994 | CIF | Al2 O12 P3 Rb3 | C m c 21 | 17.164; 8.627; 8.814 90; 90; 90 | 1305.1 | R. Nandini Devi; K. Vidyasagar Solid-State Synthesis and Characterization of Novel Aluminophosphates, A3Al2P3O12 (A = Na, K, Rb, Tl): Influence of A+ Ions on the Coordination of Aluminum Inorganic Chemistry, 2000, 39, 2391-2396 |
4321019 | CIF | F5 O4 Tc Xe | C m c 21 | 7.895; 16.204; 5.1982 90; 90; 90 | 665 | Nicolas LeBlond; David A. Dixon; Gary J. Schrobilgen Fluoride Ion Donor Properties of TcO2F3 and ReO2F3: X-ray Crystal Structures of MO2F3.SbF5 (M = Tc, Re) and TcO2F3.XeO2F2 and Raman and NMR Spectroscopic Characterization of MO2F3.PnF5 (Pn = As, Sb), [ReO2F2(CH3CN)2][SbF6], and [Re2O4F5][Sb2F11] Inorganic Chemistry, 2000, 39, 2473-2487 |
4321260 | CIF | C12 H28 F12 N4 O4 U3 | C m c 21 | 14.266; 24.513; 7.201 90; 90; 90 | 2518.2 | Simon Allen; Stephen Barlow; P. Shiv Halasyamani; J. Frederick W. Mosselmans; Dermot O'Hare; Susan M. Walker; Richard I. Walton Hydrothermal Synthesis of (C6N2H14)2(UVI2UIVO4F12), a Mixed-Valent One-Dimensional Uranium Oxyfluoride Inorganic Chemistry, 2000, 39, 3791-3798 |
4321664 | CIF | C10 H17 Cl4 Mo O | C m c 21 | 13.9735; 11.9079; 8.4183 90; 90; 90 | 1400.76 | P. Schollhammer; F. Y. Pétillon; J. Talarmin; K. W. Muir; H. K. Fun; K. Chinnakali Halogenation and Alkylation at a MoIII2(μ-S) Site. Crystal Structure of the Metal-Sulfenyl Halide Complex [Mo2(η5-C5Me5)2(μ-SMe)2(μ-SI)(CO)2]I5 Inorganic Chemistry, 2000, 39, 5879-5882 |
4321709 | CIF | Cl Cr Tb8 Te13 | C m c 21 | 4.17; 26.3485; 23.6092 90; 90; 90 | 2594 | Olivier Tougait; James A. Ibers New Series CrLn8Te13Cl (Ln = Sm, Gd, Tb): Pseudo-Misfit-Layer Compounds Inorganic Chemistry, 2000, 39, 6136-6138 |
4321710 | CIF | Cl Cr Sm8 Te13 | C m c 21 | 4.2281; 26.575; 23.829 90; 90; 90 | 2677.5 | Olivier Tougait; James A. Ibers New Series CrLn8Te13Cl (Ln = Sm, Gd, Tb): Pseudo-Misfit-Layer Compounds Inorganic Chemistry, 2000, 39, 6136-6138 |
4321711 | CIF | Cl Cr Gd8 Te13 | C m c 21 | 4.1923; 26.464; 23.73 90; 90; 90 | 2632.7 | Olivier Tougait; James A. Ibers New Series CrLn8Te13Cl (Ln = Sm, Gd, Tb): Pseudo-Misfit-Layer Compounds Inorganic Chemistry, 2000, 39, 6136-6138 |
4321814 | CIF | C8 H16 Cu2 N4 | C m c 21 | 11.889; 33.38; 9.012 90; 90; 90 | 3576.5 | Fred B. Stocker; Teodora P. Staeva; Chad M. Rienstra; Doyle Britton Crystal Structures of a Series of Complexes Produced by Reaction of Copper(I) Cyanide with Diamines Inorganic Chemistry, 1999, 38, 984-991 |
4322871 | CIF | C49 H90 B F3 N8 O8 Ru S | C m c 21 | 16.121; 21.492; 17.156 90; 90; 90 | 5944 | Yoshiaki Takahashi; Munetaka Akita; Shiro Hikichi; Yoshihiko Moro-oka Synthesis of Various Cationic Ruthenium-Aqua Complexes with Hydrotris(3,5-diisopropylpyrazolyl)borate Ligand, TpiPrRu(OH2)n(L)3-n.(CF3SO3)(THF)x, and Their Structures Supported by Hydrogen-Bonding Networks1 Inorganic Chemistry, 1998, 37, 3186-3194 |
4324923 | CIF | H3 O2 Rb | C m c 21 | 4.0892; 11.205; 6.0175 90; 90; 90 | 275.72 | Veronika Hoepfner; Richard Dronskowski RbCN3H4: The First Structurally Characterized Salt of a New Class of Guanidinate Compounds Inorganic Chemistry, 2011, 50, 3799-3803 |
4325098 | CIF | C4 H16 N2 O27 P4 U5 | C m c 21 | 15.512; 13.7953; 13.0199 90; 90; 90 | 2786.16 | Laurent Jouffret; Murielle Rivenet; Francis Abraham Linear Alkyl Diamine-Uranium-Phosphate Systems: U(VI) to U(IV) Reduction with Ethylenediamine Inorganic Chemistry, 2011, 50, 4619-4626 |
4325099 | CIF | C5 H18 N2 O27 P4 U5 | C m c 21 | 15.52; 13.89; 13.0769 90; 90; 90 | 2819 | Laurent Jouffret; Murielle Rivenet; Francis Abraham Linear Alkyl Diamine-Uranium-Phosphate Systems: U(VI) to U(IV) Reduction with Ethylenediamine Inorganic Chemistry, 2011, 50, 4619-4626 |
4325414 | CIF | Ba2 Bi In S5 | C m c 21 | 4.2535; 18.252; 12.685 90; 90; 90 | 984.8 | Lei Geng; Wen-Dan Cheng; Chen-Sheng Lin; Wei-Long Zhang; Hao Zhang; Zhang-Zhen He Syntheses and Characterization of new Mid-Infrared Transparency Compounds: Centric Ba2BiGaS5 and Acentric Ba2BiInS5 Inorganic Chemistry, 2011, 50, 5679-5686 |
4325543 | CIF | Cs2 O15 Si6 U | C m c 21 | 7.2717; 16.3061; 13.4983 90; 90; 90 | 1600.53 | Hsin-Kuan Liu; Kwang-Hwa Lii Cs2USi6O15: A Tetravalent Uranium Silicate Inorganic Chemistry, 2011, 50, 5870-5872 |
4326001 | CIF | Ca2 Cd P2 | C m c 21 | 4.2066; 16.12; 7.0639 90; 90; 90 | 479.01 | Jian Wang; Min Yang; Ming-Yan Pan; Sheng-Qing Xia; Xu-Tang Tao; Hua He; Gregory Darone; Svilen Bobev Synthesis, Crystal and Electronic Structures, and Properties of the New Pnictide Semiconductors A2CdPn2 (A= Ca, Sr, Ba, Eu;Pn= P, As) Inorganic Chemistry, 2011, 50, 8020-8027 |
4326002 | CIF | As2 Ca2 Cd | C m c 21 | 4.3163; 16.5063; 7.1418 90; 90; 90 | 508.83 | Jian Wang; Min Yang; Ming-Yan Pan; Sheng-Qing Xia; Xu-Tang Tao; Hua He; Gregory Darone; Svilen Bobev Synthesis, Crystal and Electronic Structures, and Properties of the New Pnictide Semiconductors A2CdPn2 (A= Ca, Sr, Ba, Eu;Pn= P, As) Inorganic Chemistry, 2011, 50, 8020-8027 |
4326004 | CIF | As2 Cd Sr2 | C m c 21 | 4.4459; 16.904; 7.5885 90; 90; 90 | 570.3 | Jian Wang; Min Yang; Ming-Yan Pan; Sheng-Qing Xia; Xu-Tang Tao; Hua He; Gregory Darone; Svilen Bobev Synthesis, Crystal and Electronic Structures, and Properties of the New Pnictide Semiconductors A2CdPn2 (A= Ca, Sr, Ba, Eu;Pn= P, As) Inorganic Chemistry, 2011, 50, 8020-8027 |
4326005 | CIF | As2 Ba2 Cd | C m c 21 | 4.5922; 17.4047; 8.0526 90; 90; 90 | 643.61 | Jian Wang; Min Yang; Ming-Yan Pan; Sheng-Qing Xia; Xu-Tang Tao; Hua He; Gregory Darone; Svilen Bobev Synthesis, Crystal and Electronic Structures, and Properties of the New Pnictide Semiconductors A2CdPn2 (A= Ca, Sr, Ba, Eu;Pn= P, As) Inorganic Chemistry, 2011, 50, 8020-8027 |
4326006 | CIF | As2 Cd Eu2 | C m c 21 | 4.4418; 16.847; 7.4985 90; 90; 90 | 561.1 | Jian Wang; Min Yang; Ming-Yan Pan; Sheng-Qing Xia; Xu-Tang Tao; Hua He; Gregory Darone; Svilen Bobev Synthesis, Crystal and Electronic Structures, and Properties of the New Pnictide Semiconductors A2CdPn2 (A= Ca, Sr, Ba, Eu;Pn= P, As) Inorganic Chemistry, 2011, 50, 8020-8027 |
4327185 | CIF | Ga2 Ge La2 S8 | C m c 21 | 17.696; 5.806; 11.419 90; 90; 90 | 1173.2 | Mei-Chun Chen; Peng Li; Liu-Jiang Zhou; Long-Hua Li; Ling Chen Structure Change Induced by Terminal Sulfur in Noncentrosymmetric La2Ga2GeS8 and Eu2Ga2GeS7 and Nonlinear-Optical Responses in Middle Infrared Inorganic Chemistry, 2011, 50, 12402-12404 |
4327324 | CIF | C79 H140 Mn9 O39 | C m c 21 | 25.9274; 19.6851; 21.1978 90; 90; 90 | 10819 | Nicole E. Chakov; Lev N. Zakharov; Arnold L. Rheingold; Khalil A. Abboud; George Christou New Polynuclear Manganese Clusters from the Use of the Hydrophobic Carboxylate Ligand 2,2-Dimethylbutyrate Inorganic Chemistry, 2005, 44, 4555-4567 |
4327756 | CIF | Ge6 La4 Mg5 | C m c 21 | 4.503; 20.085; 16.207 90; 90; 90 | 1465.8 | Pavlo Solokha; Serena De Negri; Monika Skrobanska; Adriana Saccone; Volodymyr Pavlyuk; Davide M. Proserpio New Ternary Germanides La4Mg5Ge6 and La4Mg7Ge6: Crystal Structure and Chemical Bonding Inorganic Chemistry, 2012, 51, 207-214 |
4328084 | CIF | C22 H42 Cr N3 O | C m c 21 | 15.7674; 13.5858; 11.1092 90; 90; 90 | 2379.73 | Stephen A. DiFranco; Nicholas A. Maciulis; Richard J. Staples; Rami J. Batrice; Aaron L. Odom Evaluation of Donor and Steric Properties of Anionic Ligands on High Valent Transition Metals Inorganic Chemistry, 2012, 51, 1187-1200 |
4328606 | CIF | C6 H11 Cl5 Ga P5 | C m c 21 | 23.2837; 13.216; 16.778 90; 90; 90 | 5162.88 | Michael H. Holthausen; Kai-Oliver Feldmann; Stephen Schulz; Alexander Hepp; Jan J. Weigand Formation of Cationic [RP5Cl]±Cages via Insertion of [RPCl]±Cations into a P-P Bond of the P4 Tetrahedron Inorganic Chemistry, 2012, 51, 3374-3387 |
4329518 | CIF | Ba2 In Se5 Y | C m c 21 | 4.2519; 18.74; 13.271 90; 90; 90 | 1057.4 | Wenlong Yin; Kai Feng; Wendong Wang; Youguo Shi; Wenyu Hao; Jiyong Yao; Yicheng Wu Syntheses, Structures, Optical and Magnetic Properties of Ba2MLnSe5 (M = Ga, In; Ln= Y, Nd, Sm, Gd, Dy, Er) Inorganic Chemistry, 2012, 51, 6860-6867 |
4329519 | CIF | Ba2 In Nd Se5 | C m c 21 | 4.298; 18.807; 13.227 90; 90; 90 | 1069.2 | Wenlong Yin; Kai Feng; Wendong Wang; Youguo Shi; Wenyu Hao; Jiyong Yao; Yicheng Wu Syntheses, Structures, Optical and Magnetic Properties of Ba2MLnSe5 (M = Ga, In; Ln= Y, Nd, Sm, Gd, Dy, Er) Inorganic Chemistry, 2012, 51, 6860-6867 |
4329520 | CIF | Ba2 In Se5 Sm | C m c 21 | 4.2868; 18.805; 13.25 90; 90; 90 | 1068.1 | Wenlong Yin; Kai Feng; Wendong Wang; Youguo Shi; Wenyu Hao; Jiyong Yao; Yicheng Wu Syntheses, Structures, Optical and Magnetic Properties of Ba2MLnSe5 (M = Ga, In; Ln= Y, Nd, Sm, Gd, Dy, Er) Inorganic Chemistry, 2012, 51, 6860-6867 |
4329521 | CIF | Ba2 Gd In Se5 | C m c 21 | 4.2695; 18.79; 13.269 90; 90; 90 | 1064.5 | Wenlong Yin; Kai Feng; Wendong Wang; Youguo Shi; Wenyu Hao; Jiyong Yao; Yicheng Wu Syntheses, Structures, Optical and Magnetic Properties of Ba2MLnSe5 (M = Ga, In; Ln= Y, Nd, Sm, Gd, Dy, Er) Inorganic Chemistry, 2012, 51, 6860-6867 |
4329522 | CIF | Ba2 Dy In Se5 | C m c 21 | 4.2529; 18.726; 13.258 90; 90; 90 | 1055.9 | Wenlong Yin; Kai Feng; Wendong Wang; Youguo Shi; Wenyu Hao; Jiyong Yao; Yicheng Wu Syntheses, Structures, Optical and Magnetic Properties of Ba2MLnSe5 (M = Ga, In; Ln= Y, Nd, Sm, Gd, Dy, Er) Inorganic Chemistry, 2012, 51, 6860-6867 |
4329523 | CIF | Ba2 Er In Se5 | C m c 21 | 4.2345; 18.723; 13.255 90; 90; 90 | 1050.9 | Wenlong Yin; Kai Feng; Wendong Wang; Youguo Shi; Wenyu Hao; Jiyong Yao; Yicheng Wu Syntheses, Structures, Optical and Magnetic Properties of Ba2MLnSe5 (M = Ga, In; Ln= Y, Nd, Sm, Gd, Dy, Er) Inorganic Chemistry, 2012, 51, 6860-6867 |
4330637 | CIF HKL | Cu5.143 In2 Sb2 | C m c 21 | 10.196; 8.487; 7.388 90; 90; 90 | 639.3 | Carola J. Müller; Sven Lidin; Susana Ramos de Debiaggi; Crispulo E. Deluque Toro; Armando Fernández Guillermet Synthesis, Structural Characterization, and Ab Initio Study of Cu5+δIn2+xSb2-x: A New B8-Related Structure Type Inorganic Chemistry, 2012, 51, 10787-10792 |
4330686 | CIF | C31 H42 Cu N4 O3 | C m c 21 | 14.6152; 14.024; 14.7774 90; 90; 90 | 3028.8 | Xiaofeng Zhang; Deguang Huang; Yu-Sheng Chen; R. H. Holm Synthesis of Binucleating Macrocycles and Their Nickel(II) Hydroxo- and Cyano-Bridged Complexes with Divalent Ions: Anatomical Variation of Ligand Features Inorganic Chemistry, 2012, 51, 11017-11029 |
4330818 | CIF | C2 H9.5 Ag0.25 O14.25 P2 U1.5 | C m c 21 | 18.6688; 17.9109; 9.4926 90; 90; 90 | 3174.1 | Weiting Yang; Hong-Yue Wu; Run-Xue Wang; Qing-Jiang Pan; Zhong-Ming Sun; Hongjie Zhang From 1D Chain to 3D Framework Uranyl Diphosphonates: Syntheses, Crystal Structures, and Selective Ion Exchange Inorganic Chemistry, 2012, 51, 11458-11465 |
4330824 | CIF | C2 H9 O13.5 P2 U1.5 | C m c 21 | 18.5715; 17.9278; 9.5221 90; 90; 90 | 3170.3 | Weiting Yang; Hong-Yue Wu; Run-Xue Wang; Qing-Jiang Pan; Zhong-Ming Sun; Hongjie Zhang From 1D Chain to 3D Framework Uranyl Diphosphonates: Syntheses, Crystal Structures, and Selective Ion Exchange Inorganic Chemistry, 2012, 51, 11458-11465 |
4330825 | CIF | C2 H6 Na O12.5 P2 U1.5 | C m c 21 | 18.5849; 17.9529; 9.5115 90; 90; 90 | 3173.5 | Weiting Yang; Hong-Yue Wu; Run-Xue Wang; Qing-Jiang Pan; Zhong-Ming Sun; Hongjie Zhang From 1D Chain to 3D Framework Uranyl Diphosphonates: Syntheses, Crystal Structures, and Selective Ion Exchange Inorganic Chemistry, 2012, 51, 11458-11465 |
4330826 | CIF | C2 H7.66 K0.48 O13.33 P2 U1.5 | C m c 21 | 18.4365; 17.9175; 9.5296 90; 90; 90 | 3148 | Weiting Yang; Hong-Yue Wu; Run-Xue Wang; Qing-Jiang Pan; Zhong-Ming Sun; Hongjie Zhang From 1D Chain to 3D Framework Uranyl Diphosphonates: Syntheses, Crystal Structures, and Selective Ion Exchange Inorganic Chemistry, 2012, 51, 11458-11465 |
4330827 | CIF | C2 H7.45 Cs0.14 O13.23 P2 U1.5 | C m c 21 | 18.663; 17.8829; 9.533 90; 90; 90 | 3181.6 | Weiting Yang; Hong-Yue Wu; Run-Xue Wang; Qing-Jiang Pan; Zhong-Ming Sun; Hongjie Zhang From 1D Chain to 3D Framework Uranyl Diphosphonates: Syntheses, Crystal Structures, and Selective Ion Exchange Inorganic Chemistry, 2012, 51, 11458-11465 |
4330894 | CIF | Ba2 In Te5 Y | C m c 21 | 4.5137; 20.087; 14.093 90; 90; 90 | 1277.8 | Wenlong Yin; Wendong Wang; Lei Bai; Kai Feng; Youguo Shi; Wenyu Hao; Jiyong Yao; Yicheng Wu Syntheses, Structures, Physical Properties, and Electronic Structures of Ba2MLnTe5 (M = Ga and Ln = Sm, Gd, Dy, Er, Y; M = In and Ln = Ce, Nd, Sm, Gd, Dy, Er, Y) Inorganic Chemistry, 2012, 51, 11736-11744 |
4330897 | CIF | Ba2 Dy Ga Te5 | C m c 21 | 4.4638; 20.0925; 14.0899 90; 90; 90 | 1263.71 | Wenlong Yin; Wendong Wang; Lei Bai; Kai Feng; Youguo Shi; Wenyu Hao; Jiyong Yao; Yicheng Wu Syntheses, Structures, Physical Properties, and Electronic Structures of Ba2MLnTe5 (M = Ga and Ln = Sm, Gd, Dy, Er, Y; M = In and Ln = Ce, Nd, Sm, Gd, Dy, Er, Y) Inorganic Chemistry, 2012, 51, 11736-11744 |
4330898 | CIF | Ba2 Er Ga Te5 | C m c 21 | 4.4404; 20.001; 14.034 90; 90; 90 | 1246.4 | Wenlong Yin; Wendong Wang; Lei Bai; Kai Feng; Youguo Shi; Wenyu Hao; Jiyong Yao; Yicheng Wu Syntheses, Structures, Physical Properties, and Electronic Structures of Ba2MLnTe5 (M = Ga and Ln = Sm, Gd, Dy, Er, Y; M = In and Ln = Ce, Nd, Sm, Gd, Dy, Er, Y) Inorganic Chemistry, 2012, 51, 11736-11744 |
4330899 | CIF | Ba2 Ga Te5 Y | C m c 21 | 4.4412; 20.035; 14.053 90; 90; 90 | 1250.4 | Wenlong Yin; Wendong Wang; Lei Bai; Kai Feng; Youguo Shi; Wenyu Hao; Jiyong Yao; Yicheng Wu Syntheses, Structures, Physical Properties, and Electronic Structures of Ba2MLnTe5 (M = Ga and Ln = Sm, Gd, Dy, Er, Y; M = In and Ln = Ce, Nd, Sm, Gd, Dy, Er, Y) Inorganic Chemistry, 2012, 51, 11736-11744 |
4330900 | CIF | Ba2 Ce In Te5 | C m c 21 | 4.5781; 20.292; 14.079 90; 90; 90 | 1307.9 | Wenlong Yin; Wendong Wang; Lei Bai; Kai Feng; Youguo Shi; Wenyu Hao; Jiyong Yao; Yicheng Wu Syntheses, Structures, Physical Properties, and Electronic Structures of Ba2MLnTe5 (M = Ga and Ln = Sm, Gd, Dy, Er, Y; M = In and Ln = Ce, Nd, Sm, Gd, Dy, Er, Y) Inorganic Chemistry, 2012, 51, 11736-11744 |
4330901 | CIF | Ba2 In Nd Te5 | C m c 21 | 4.5579; 20.194; 14.104 90; 90; 90 | 1298.2 | Wenlong Yin; Wendong Wang; Lei Bai; Kai Feng; Youguo Shi; Wenyu Hao; Jiyong Yao; Yicheng Wu Syntheses, Structures, Physical Properties, and Electronic Structures of Ba2MLnTe5 (M = Ga and Ln = Sm, Gd, Dy, Er, Y; M = In and Ln = Ce, Nd, Sm, Gd, Dy, Er, Y) Inorganic Chemistry, 2012, 51, 11736-11744 |
4330902 | CIF | Ba2 In Sm Te5 | C m c 21 | 4.5349; 20.151; 14.086 90; 90; 90 | 1287.2 | Wenlong Yin; Wendong Wang; Lei Bai; Kai Feng; Youguo Shi; Wenyu Hao; Jiyong Yao; Yicheng Wu Syntheses, Structures, Physical Properties, and Electronic Structures of Ba2MLnTe5 (M = Ga and Ln = Sm, Gd, Dy, Er, Y; M = In and Ln = Ce, Nd, Sm, Gd, Dy, Er, Y) Inorganic Chemistry, 2012, 51, 11736-11744 |
4330903 | CIF | Ba2 Gd In Te5 | C m c 21 | 4.5014; 20.064; 14.078 90; 90; 90 | 1271.5 | Wenlong Yin; Wendong Wang; Lei Bai; Kai Feng; Youguo Shi; Wenyu Hao; Jiyong Yao; Yicheng Wu Syntheses, Structures, Physical Properties, and Electronic Structures of Ba2MLnTe5 (M = Ga and Ln = Sm, Gd, Dy, Er, Y; M = In and Ln = Ce, Nd, Sm, Gd, Dy, Er, Y) Inorganic Chemistry, 2012, 51, 11736-11744 |
4330904 | CIF | Ba2 Dy In Te5 | C m c 21 | 4.5198; 20.065; 14.089 90; 90; 90 | 1277.7 | Wenlong Yin; Wendong Wang; Lei Bai; Kai Feng; Youguo Shi; Wenyu Hao; Jiyong Yao; Yicheng Wu Syntheses, Structures, Physical Properties, and Electronic Structures of Ba2MLnTe5 (M = Ga and Ln = Sm, Gd, Dy, Er, Y; M = In and Ln = Ce, Nd, Sm, Gd, Dy, Er, Y) Inorganic Chemistry, 2012, 51, 11736-11744 |
4330905 | CIF | Ba2 Er In Te5 | C m c 21 | 4.4998; 20.07; 14.079 90; 90; 90 | 1271.5 | Wenlong Yin; Wendong Wang; Lei Bai; Kai Feng; Youguo Shi; Wenyu Hao; Jiyong Yao; Yicheng Wu Syntheses, Structures, Physical Properties, and Electronic Structures of Ba2MLnTe5 (M = Ga and Ln = Sm, Gd, Dy, Er, Y; M = In and Ln = Ce, Nd, Sm, Gd, Dy, Er, Y) Inorganic Chemistry, 2012, 51, 11736-11744 |
4331380 | CIF | B Cl H5 N | C m c 21 | 6.7034; 5.9235; 8.292 90; 90; 90 | 329.26 | Hima K. Lingam; Cong Wang; Judith C. Gallucci; Xuenian Chen; Sheldon G. Shore New Syntheses and Structural Characterization of NH3BH2Cl and (BH2NH2)3 and Thermal Decomposition Behavior of NH3BH2Cl Inorganic Chemistry, 2012, 51, 13430-13436 |
4332154 | CIF | C22 H12 Br4 Fe O2 S12 Se4 | C m c 21 | 38.858; 7.144; 13.278 90; 90; 90 | 3686 | Fujiwara, Hideki; Hayashi, Toshiki; Sugimoto, Toyonari; Nakazumi, Hiroyuki; Noguchi, Satoru; Li, Lin; Yokogawa, Keiichi; Yasuzuka, Syuma; Murata, Keizo; Mori, Takehiko Magnetoresistance Effects Evidencing the π−d Interaction in Metallic Organic Conductors, (EDT-DSDTFVO)2•MX4(M = Fe, Ga; X = Cl, Br) Inorganic Chemistry, 2006, 45, 5712-5714 |
4332773 | CIF | C17 H11 Au Cl N5 Pt | C m c 21 | 6.4361; 13.337; 19.6 90; 90; 90 | 1682.4 | Hayoun, Rebecca; Zhong, Diane K.; Rheingold, Arnold L.; Doerrer, Linda H. Gold(III) and Platinum(II) Polypyridyl Double Salts and a General Metathesis Route to Metallophilic Interactions Inorganic Chemistry, 2006, 45, 6120-6122 |
4334425 | CIF | C34 H40 Cu F6 N4 O8 S2 | C m c 21 | 12.3248; 17.1869; 19.2754 90; 90; 90 | 4083 | Katsuo Fukuhara; Shin-ichiro Noro; Kunihisa Sugimoto; Tomoyuki Akutagawa; Kazuya Kubo; Takayoshi Nakamura Porous Coordination Polymer Polymorphs with Different Flexible Pores Using a Structurally Flexible and Bent 1,3-Bis(4-pyridyl)propane Ligand Inorganic Chemistry, 2013, 52, 4229-4237 |
4335128 | CIF | C20 H40 B10 O2 Rh2 | C m c 21 | 19.855; 9.4556; 14.515 90; 90; 90 | 2725.1 | Dipak Kumar Roy; Bijan Mondal; Pritam Shankhari; R. S. Anju; K. Geetharani; Shaikh M. Mobin; Sundargopal Ghosh Supraicosahedral Polyhedra in Metallaboranes: Synthesis and Structural Characterization of 12-, 15-, and 16-Vertex Rhodaboranes Inorganic Chemistry, 2013, 52, 6705-6712 |
4335359 | CIF | C18 H36 N3 O7 P Pd3 | C m c 21 | 15.899; 17.194; 9.5281 90; 90; 90 | 2604.7 | Arvind K. Gupta; S. Arun Dixith Reddy; Ramamoorthy Boomishankar Facile Formation of Stable Tris(imido)phosphate Trianions as Their Tri- and Hexanuclear Pd(II) Complexes in Protic Solvents Inorganic Chemistry, 2013, 52, 7608-7614 |
4337511 | CIF | Br12 F148 K60 Mo36 O58.32 | C m c 21 | 19.7095; 34.1319; 7.7539 90; 90; 90 | 5216.2 | Holland, Michael; Donakowski, Martin D.; Pozzi, Eric A.; Rasmussen, Andrew M.; Tran, Thanh Thao; Pease-Dodson, Shannon E; Halasyamani, P. Shiv; Seideman, Tamar; Van Duyne, Richard P.; Poeppelmeier, Kenneth R. Polar alignment of Λ-shaped basic building units within transition metal oxide fluoride materials. Inorganic chemistry, 2014, 53, 221-228 |
4337744 | CIF | B3 Cs O7 Zn2 | C m c 21 | 8.4293; 19.255; 14.5767 90; 90; 90 | 2365.89 | Zhao, Sangen; Zhang, Jia; Zhang, Shu-Quan; Sun, Zhihua; Lin, Zheshuai; Wu, Yicheng; Hong, Maochun; Luo, Junhua A New UV Nonlinear Optical Material CsZn2B3O7: ZnO4 Tetrahedra Double the Efficiency of Second-Harmonic Generation. Inorganic chemistry, 2014, 53, 2521-2527 |
4339792 | CIF | C36 H48 Al N O3 | C m c 21 | 17.616; 22.889; 9.5032 90; 90; 90 | 3831.8 | Su, Weiping; Kobayashi, Junji; Ellern, Arkady; Kawashima, Takayuki; Verkade, John G. Steric stabilization of a monomeric proalumatrane: experimental and theoretical studies. Inorganic chemistry, 2007, 46, 7953-7959 |
4340720 | CIF | C68 H59 F12 N13 O14 S4 V2 | C m c 21 | 14.8802; 22.0171; 21.9728 90; 90; 90 | 7198.7 | King, Amanda E.; Nippe, Michael; Atanasov, Mihail; Chantarojsiri, Teera; Wray, Curtis A.; Bill, Eckhard; Neese, Frank; Long, Jeffrey R.; Chang, Christopher J. A Well-Defined Terminal Vanadium(III) Oxo Complex. Inorganic chemistry, 2014, 53, 11388-11395 |
4341245 | CIF | C12 H28 Cd Cl4 N2 | C m c 21 | 27.432; 8.4349; 8.0648 90; 90; 90 | 1866.1 | Liao, Wei-Qiang; Ye, Heng-Yun; Fu, Da-Wei; Li, Peng-Fei; Chen, Li-Zhuang; Zhang, Yi Temperature-Triggered Reversible Dielectric and Nonlinear Optical Switch Based on the One-Dimensional Organic-Inorganic Hybrid Phase Transition Compound [C6H11NH3]2CdCl4. Inorganic chemistry, 2014, 53, 11146-11151 |
4341766 | CIF | Ba14 Ge78 | C m c 21 | 29.5729; 11.2228; 12.7992 90; 90; 90 | 4247.94 | Akselrud, Lev; Wosylus, Aron; Castillo, Rodrigo; Aydemir, Umut; Prots, Yurii; Schnelle, Walter; Grin, Yuri; Schwarz, Ulrich BaGe6 and BaGe6-x: Incommensurately Ordered Vacancies as Electron Traps. Inorganic chemistry, 2014, 141126111906003 |
4342418 | CIF | Ni O6 Pb Se2 | C m c 21 | 5.4715; 9.1963; 11.4436 90; 90; 90 | 575.81 | Kovrugin, Vadim M.; Colmont, Marie; Terryn, Christine; Colis, Silviu; Siidra, Oleg I.; Krivovichev, Sergey V.; Mentré, Olivier pH Controlled Pathway and Systematic Hydrothermal Phase Diagram for Elaboration of Synthetic Lead Nickel Selenites. Inorganic chemistry, 2015, 54, 2425 |
4343211 | CIF | C72 H42 Cu6 N2 O30 | C m c 21 | 14.4693; 65.138; 28.8888 90; 90; 90 | 27228 | Duan, Xing; Wu, Chuande; Xiang, Shengchang; Zhou, Wei; Yildirim, Taner; Cui, Yuanjing; Yang, Yu; Chen, Banglin; Qian, Guodong Novel microporous metal-organic framework exhibiting high acetylene and methane storage capacities. Inorganic chemistry, 2015, 54, 4377-4381 |
4343504 | CIF | C49 H58 B6 Cl2 Ho2 N32 | C m c 21 | 13.442; 17.306; 14.691 90; 90; 90 | 3418 | Lannes, Anthony; Luneau, Dominique New Family of Lanthanide-Based Complexes with Different Scorpionate-Type Ligands: A Rare Case Where Dysprosium and Ytterbium Analogues Display Single-Ion-Magnet Behavior. Inorganic chemistry, 2015, 54, 6736-6743 |
4343505 | CIF | C25 H30 B3 Cl2 N16 Yb | C m c 21 | 13.663; 17.178; 14.661 90; 90; 90 | 3441 | Lannes, Anthony; Luneau, Dominique New Family of Lanthanide-Based Complexes with Different Scorpionate-Type Ligands: A Rare Case Where Dysprosium and Ytterbium Analogues Display Single-Ion-Magnet Behavior. Inorganic chemistry, 2015, 54, 6736-6743 |
4343506 | CIF | C49 H58 B6 Cl2 Gd2 N32 | C m c 21 | 13.372; 17.327; 14.665 90; 90; 90 | 3398 | Lannes, Anthony; Luneau, Dominique New Family of Lanthanide-Based Complexes with Different Scorpionate-Type Ligands: A Rare Case Where Dysprosium and Ytterbium Analogues Display Single-Ion-Magnet Behavior. Inorganic chemistry, 2015, 54, 6736-6743 |
4343507 | CIF | C49 H58 B6 Cl2 Dy2 N32 | C m c 21 | 13.396; 17.295; 14.667 90; 90; 90 | 3398 | Lannes, Anthony; Luneau, Dominique New Family of Lanthanide-Based Complexes with Different Scorpionate-Type Ligands: A Rare Case Where Dysprosium and Ytterbium Analogues Display Single-Ion-Magnet Behavior. Inorganic chemistry, 2015, 54, 6736-6743 |
4343508 | CIF | C49 H58 B6 Cl2 Ho2 N32 | C m c 21 | 13.364; 17.328; 14.669 90; 90; 90 | 3397 | Lannes, Anthony; Luneau, Dominique New Family of Lanthanide-Based Complexes with Different Scorpionate-Type Ligands: A Rare Case Where Dysprosium and Ytterbium Analogues Display Single-Ion-Magnet Behavior. Inorganic chemistry, 2015, 54, 6736-6743 |
4343657 | CIF | As S | C m c 21 | 20.375; 8.508; 11.224 90; 90; 90 | 1945.69 | Gibler, D.D.; Zalkin, A.; Adams, C.J.; Fischer, M.; Bartlett, N. Structural studies of trifluorosulfur(IV)yl, (S F3)(+), salts including the crystal structure of (S F3)(+) (B F4)(-) Inorganic Chemistry, 1972, 11, 2325-2329 |
4344111 | CIF | F2 N P | C m c 21 | 8.69; 5.38; 4.86 90; 90; 90 | 227.216 | Allcock, H.R.; Kugel, R.L.; Stroh, E.G. Phosphonitrilic Compounds. XII. The Structure and Properties of Poly(difluorophosphazene) Inorganic Chemistry, 1972, 11, 1120-1123 |
4344196 | CIF | Cl9 H22 Mo2 N5 O | C m c 21 | 10.528; 13.219; 13.129 90; 90; 90 | 1827.16 | Brencic, J.V.; Cotton, F.A. Stoichiometric and structural characterization of the compound (N H4)5 Mo2 Cl9 * H2 O Inorganic Chemistry, 1970, 9, 346-351 |
4345172 | CIF | C104 H500 Cl21 O378 Tb37 | C m c 21 | 48.1145; 26.6472; 28.6307 90; 90; 90 | 36708 | Zhou, Yang; Zheng, Xiu-Ying; Cai, Jing; Hong, Zi-Feng; Yan, Zhi-Hao; Kong, Xiang-Jian; Ren, Yan-Ping; Long, La-Sheng; Zheng, Lan-Sun Three Giant Lanthanide Clusters Ln37 (Ln = Gd, Tb, and Eu) Featuring A Double-Cage Structure. Inorganic chemistry, 2017, 56, 2037-2041 |
4345173 | CIF | C104 H490 Cl21 Eu37 O378 | C m c 21 | 49.948; 27.552; 29.639 90; 90; 90 | 40788 | Zhou, Yang; Zheng, Xiu-Ying; Cai, Jing; Hong, Zi-Feng; Yan, Zhi-Hao; Kong, Xiang-Jian; Ren, Yan-Ping; Long, La-Sheng; Zheng, Lan-Sun Three Giant Lanthanide Clusters Ln37 (Ln = Gd, Tb, and Eu) Featuring A Double-Cage Structure. Inorganic chemistry, 2017, 56, 2037-2041 |
4346235 | CIF | C36 H90 Mn6 P6 Te6 | C m c 21 | 20.8798; 14.5239; 22.4484 90; 90; 90 | 6807.6 | Choi, Bonnie; Paley, Daniel W.; Siegrist, Theo; Steigerwald, Michael L.; Roy, Xavier Ligand Control of Manganese Telluride Molecular Cluster Core Nuclearity. Inorganic chemistry, 2015, 54, 8348-8355 |
4346763 | CIF | C25 H23 Cl4 F6 N3 O3 P Re | C m c 21 | 16.252; 15.88; 12.165 90; 90; 90 | 3139.6 | Yempally, Veeranna; Fan, Wai Yip; Arndtsen, Bruce A.; Bengali, Ashfaq A. Intramolecular C-C Bond Coupling of Nitriles to a Diimine Ligand in Group 7 Metal Tricarbonyl Complexes. Inorganic chemistry, 2015, 54, 11441-11449 |
4348526 | CIF | B3 H8 K3 O10 | C m c 21 | 13.806; 7.91; 9.093 90; 90; 90 | 993 | Liu, Qiong; Zhang, Xiangyu; Yang, Zhihua; Zhang, Fangfang; Liu, Lili; Han, Jian; Li, Zhi; Pan, Shilie K3B3O4(OH)4·2H2O: A UV Nonlinear Optical Crystal with Isolated [B3O4(OH)4](3-) Anion Groups. Inorganic chemistry, 2016, 55, 8744-8749 |
4348575 | CIF | C10 H16 B2 Cl6 P2 | C m c 21 | 10.3485; 13.475; 13.74 90; 90; 90 | 1916 | Burt, Jennifer; Emsley, James W.; Levason, William; Reid, Gillian; Tinkler, Iain S. Systematics of BX3 and BX2(+) Complexes (X = F, Cl, Br, I) with Neutral Diphosphine and Diarsine Ligands. Inorganic chemistry, 2016, 55, 8852-8864 |
4349711 | CIF | Ag6 Ba6 In2 Te12 | C m c 21 | 4.5669; 27.9366; 13.3819 90; 90; 90 | 1707.31 | Lee, M.-Y.; Bilc, D. I.; Symeou, E.; Lin, Y.-C.; Liang, I.-C.; Kyratsi, T.; Hsu, K.-F. Synthesis, crystal structure and thermoelectric properties of a new metal telluride Ba3Ag3InTe6 Inorganic Chemistry Frontiers, 2017, 4, 1458 |
4500311 | CIF | C29 H22 F5.92 N2 O4 Zn | C m c 21 | 21.626; 14.6622; 17.777 90; 90; 90 | 5636.8 | Pachfule, Pradip; Das, Raja; Poddar, Pankaj; Banerjee, Rahul Solvothermal Synthesis, Structure, and Properties of Metal Organic Framework Isomers Derived from a Partially Fluorinated Link Crystal Growth & Design, 2011, 11, 1215 |
4501119 | CIF | C6 H14 Br2 N2 | C m c 21 | 7.0917; 12.28; 11.4693 90; 90; 90 | 998.8 | Andrzejewski, Michał; Olejniczak, Anna; Katrusiak, Andrzej Humidity Control of Isostructural Dehydration and Pressure-Induced Polymorphism in 1,4-Diazabicyclo[2.2.2]octane Dihydrobromide Monohydrate Crystal Growth & Design, 2011, 11, 4892 |
4501122 | CIF | C6 H16 Br2 N2 O | C m c 21 | 7.185; 12.382; 11.119 90; 90; 90 | 989.2 | Andrzejewski, Michał; Olejniczak, Anna; Katrusiak, Andrzej Humidity Control of Isostructural Dehydration and Pressure-Induced Polymorphism in 1,4-Diazabicyclo[2.2.2]octane Dihydrobromide Monohydrate Crystal Growth & Design, 2011, 11, 4892 |
4501312 | CIF | C138 H92 Cd12 N115 | C m c 21 | 34.3111; 40.5399; 20.3265 90; 90; 90 | 28273.5 | Pachfule, Pradip; Banerjee, Rahul Porous Nitrogen Rich Cadmium-Tetrazolate Based Metal Organic Framework (MOF) for H2and CO2Uptake Crystal Growth & Design, 2011, 11, 5176 |
4501485 | CIF | C30 H40 Cd2 N2 O11 S | C m c 21 | 18.8555; 31.189; 12.0975 90; 90; 90 | 7114.3 | Liang, Xiao-Qiang; Li, Dong-Ping; Li, Cheng-Hui; Zhou, Xin-Hui; Li, Yi-Zhi; Zuo, Jing-Lin; You, Xiao-Zeng Syntheses, Structures, and Physical Properties of Camphorate Coordination Polymers Controlled by Semirigid Auxiliary Ligands with Variable Coordination Positions and Conformations Crystal Growth & Design, 2010, 10, 2596 |
4502493 | CIF | C10 H12 Br Cd3 N15 O | C m c 21 | 10.7383; 26.276; 7.8516 90; 90; 90 | 2215.4 | Li, Dong-Ping; Zhou, Xin-Hui; Liang, Xiao-Qiang; Li, Cheng-Hui; Chen, Chao; Liu, Jian; You, Xiao-Zeng Novel Structural Diversity of Triazolate-Based Coordination Polymers Generated Solvothermally with Anions Crystal Growth & Design, 2010, 10, 2136 |
4503067 | CIF | C H4 O | C m c 21 | 6.401; 7.22; 4.647 90; 90; 90 | 214.76 | Kirchner, Michael T.; Das, Dinabandhu; Boese, Roland Cocrystallization with Acetylene: Molecular Complex with Methanol Crystal Growth & Design, 2008, 8, 763 |
4504503 | CIF | C114 H8 Cl F20 Fe N4 | C m c 21 | 24.123; 19.831; 14.441 90; 90; 90 | 6908 | Olmstead, Marilyn M.; Nurco, Daniel J. Fluorinated Tetraphenylporphyrins as Cocrystallizing Agents for C60and C70 Crystal Growth & Design, 2006, 6, 109 |
4507250 | CIF | C17 H8 In N0 O9 | C m c 21 | 9.953; 24.553; 17.799 90; 90; 90 | 4350 | Lin, Zu-Jin; Han, Li-Wei; Wu, Dong-Shuang; Huang, Yuan-Biao; Cao, Rong Structure Versatility of Coordination Polymers Constructed from a Semirigid Tetracarboxylate Ligand: Syntheses, Structures, and Photoluminescent Properties Crystal Growth & Design, 2013, 13, 255 |
4509431 | CIF | Ag3 K2 S7 Sb3 | C m c 21 | 24.8053; 9.0346; 6.7517 90; 90; 90 | 1513.1 | Yao, Hua-Gang; Ji, Min; Ji, Shou-Hua; Zhang, Ren-Chun; An, Yong-Lin; Ning, Gui-ling Solvothermal Syntheses of Two Novel Layered Quaternary Silver−Antimony(III) Sulfides with Different Strategies Crystal Growth & Design, 2009, 9, 3821 |
4510489 | CIF | C10 H14 O | C m c 21 | 6.8884; 10.83; 10.658 90; 90; 90 | 795.1 | Negrier, P.; Barrio, M.; Romanini, M.; Tamarit, J. Ll.; Mondieig, D.; Krivchikov, A. I.; Kepinski, L.; Jezowski, A.; Szewczyk, D. Polymorphism of 2-Adamantanone Crystal Growth & Design, 2014, 14, 2626 |
4512701 | CIF | C46 H45.5 N3 O22.5 Zn4 | C m c 21 | 54.076; 15.3088; 16.0309 90; 90; 90 | 13271 | Hill, Matthew D.; El-Hankari, Samir; Chiacchia, Mauro; Tizzard, Graham J.; Coles, Simon J.; Bradshaw, Darren; Kitchen, Jonathan A.; Keene, Tony D. Additive Effects in the Formation of Fluorescent Zinc Metal‒Organic Frameworks with 5-Hydroxyisophthalate Crystal Growth & Design, 2015, 15, 1452 |
4512914 | CIF | Cs2 O15 Si6 Th | C m c 21 | 7.2813; 16.42; 13.591 90; 90; 90 | 1624.9 | Mann, J. Matthew; McMillen, Colin D.; Kolis, Joseph W. Crystal Chemistry of Alkali Thorium Silicates Under Hydrothermal Conditions Crystal Growth & Design, 2015, 15, 2643 |
4514559 | CIF | C45 H40 N2 O2 S | C m c 21 | 36.7326; 7.4035; 12.5047 90; 90; 90 | 3400.7 | Stachelek, Patrycja; Ward, Jonathan S.; Dos Santos, Paloma L.; Danos, Andrew; Colella, Marco; Haase, Nils; Raynes, Samuel J.; Batsanov, Andrei S.; Bryce, Martin R.; Monkman, Andrew P. Molecular Design Strategies for Color Tuning of Blue TADF Emitters. ACS applied materials & interfaces, 2019, 11, 27125-27133 |
4516202 | CIF | C4 H12 Cl2 N Pb0.5 | C m c 21 | 27.783; 7.951; 7.7627 90; 90; 90 | 1714.8 | Dutta, Sumit Kumar; Dutta, Anirban; Das Adhikari, Samrat; Pradhan, Narayan Doping Mn2+ in Single-Crystalline Layered Perovskite Microcrystals ACS Energy Letters, 2018, 4, 343 |
4517594 | CIF | C8 H24 Cl4 N2 Pb | C m c 21 | 27.9864; 7.987; 7.8338 90; 90; 90 | 1751.1 | Tu, Qing; Spanopoulos, Ioannis; Vasileiadou, Eugenia Savvas; Li, Xiaotong; Kanatzidis, Mercouri G.; Shekhawat, Gajendra S.; Dravid, Vinayak P. Exploring the Factors Affecting the Mechanical Properties of 2D Hybrid Organic-Inorganic Perovskites. ACS applied materials & interfaces, 2020 |
4518240 | CIF | C3 H8 Br3 Cd N S | C m c 21 | 7.7262; 17.898; 6.8819 90; 90; 90 | 951.65 | He, Lei; Liu, Yuting; Shi, Pingping; Cai, Hongling; Fu, Dawei; Ye, Qiong Energy Harvesting and Pd(II) Sorption Based on Organic-Inorganic Hybrid Perovskites. ACS applied materials & interfaces, 2020 |
4518241 | CIF | C3 H8 Br3 Cd N S | C m c 21 | 7.7434; 17.9097; 6.8556 90; 90; 90 | 950.75 | He, Lei; Liu, Yuting; Shi, Pingping; Cai, Hongling; Fu, Dawei; Ye, Qiong Energy Harvesting and Pd(II) Sorption Based on Organic-Inorganic Hybrid Perovskites. ACS applied materials & interfaces, 2020 |
4518417 | CIF | Cs2 H3 O2 S14 Sb9 | C m c 21 | 29.0335; 9.8648; 11.2544 90; 90; 90 | 3223.37 | Liao, Yi-Yu; Li, Jian-Rong; Zhang, Bo; Sun, Hai-Yan; Ma, Wen; Jin, Jian-Ce; Feng, Mei-Ling; Huang, Xiao-Ying Robust and Flexible Thioantimonate Materials for Cs+ Remediation with Distinctive Structural Transformation: A Clear Insight into the Ion-Exchange Mechanism ACS Applied Materials & Interfaces, 2021 |
4518418 | CIF | C3 H18 N3 S15 Sb9 | C m c 21 | 29.5767; 9.8711; 22.8189 90; 90; 90 | 6662.1 | Liao, Yi-Yu; Li, Jian-Rong; Zhang, Bo; Sun, Hai-Yan; Ma, Wen; Jin, Jian-Ce; Feng, Mei-Ling; Huang, Xiao-Ying Robust and Flexible Thioantimonate Materials for Cs+ Remediation with Distinctive Structural Transformation: A Clear Insight into the Ion-Exchange Mechanism ACS Applied Materials & Interfaces, 2021 |
4518419 | CIF | H7 K2 O4 S14 Sb9 | C m c 21 | 28.582; 9.903; 11.2422 90; 90; 90 | 3182.1 | Liao, Yi-Yu; Li, Jian-Rong; Zhang, Bo; Sun, Hai-Yan; Ma, Wen; Jin, Jian-Ce; Feng, Mei-Ling; Huang, Xiao-Ying Robust and Flexible Thioantimonate Materials for Cs+ Remediation with Distinctive Structural Transformation: A Clear Insight into the Ion-Exchange Mechanism ACS Applied Materials & Interfaces, 2021 |
4519421 | CIF | C24 H28 N2 O | C m c 21 | 21.798; 8.9774; 9.6932 90; 90; 90 | 1896.9 | Fomina, Marina V.; Vatsadze, Sergey Z.; Freidzon, Alexandra Ya.; Kuz’mina, Lyudmila G.; Moiseeva, Anna A.; Starostin, Roman O.; Nuriev, Vyacheslav N.; Gromov, Sergey P. Structure–Property Relationships of Dibenzylidenecyclohexanones ACS Omega, 2022, 7, 10087-10099 |
5000288 | CIF | C21 H50 Cl N O P2 Ru | C m c 21 | 21.4725; 8.8163; 14.0146 90; 90; 90 | 2653.08 | Coalter, Joseph N.; Huffman, John C.; Caulton, Kenneth G. Cleavage of H-C(sp^2^) and C(sp^2^)-X Bonds (X = Alkyl, Aryl, OR, NR~2~): Facile Decarbonylation, Isonitrile Abstraction, or Dehydrogenation of Aldehydes, Esters, Amides, Amines, and Imines by [RuHCl(P^i^Pr~3~)~2~]~2~ Organometallics, 2000, 19, 3569-3578 |
5000291 | CIF | C22 H50 Cl N P2 Ru | C m c 21 | 21.4753; 8.8416; 13.4685 90; 90; 90 | 2557.35 | Ferrando-Miguel, German; Coalter, III, Joseph N.; Gérard, Hélène; Huffman, John C.; Eisenstein, Odile; Caulton, Kenneth G. Geminal Dehydrogenation of Ether and Amine C(sp^3^)H~2~ Groups by Electron-Rich Ru(II) and Os New Journal of Chemistry, 2002, 26, 687-700 |
6000052 | CIF | O9 Re2 V | C m c 21 | 5.711; 14.699; 8.823 90; 90; 90 | 740.66 | Bastide, Beatrice; Enjalbert, Renee; Fuess, Hartmut; Galy, Jean VO(ReO4)(2): solid state and structural chemistry Solid State Sciences, 2000, 2, 545-552 |
6000624 | CIF | Bi Ca2 O6 V | C m c 21 | 8.892; 11.961; 5.546 90; 90; 90 | 589.86 | Radosavljevic, I.; Evans, J. S. O.; Sleight, A. W. Synthesis and structure of BiCa2VO6 Journal of Solid State Chemistry, 1998, 137, 143-147 |
7000709 | CIF | C42 H57 Co3 S6 | C m c 21 | 19.395; 15.452; 14.469 90; 90; 90 | 4336 | Shibata, Yusuke; Zhu, Baohua; Kume, Shoko; Nishihara, Hiroshi Development of a versatile synthesis method for trinuclear Co(iii), Rh(iii), and Ir(iii) dithiolene complexes, and their crystal structures and multi-step redox properties Dalton Transactions, 2009, 1939-1943 |
7001143 | CIF | C18 H33 Ag3 N9 O13 S2 | C m c 21 | 20.916; 12.296; 11.204 90; 90; 90 | 2881.5 | Wu, Hua; Dong, Xian-Wu; Ma, Jian-Fang; Liu, Hai-Yan; Yang, Jin; Bai, Hong-Ye Influence of anionic sulfonate-containing and nitrogen-containing mixed-ligands on the structures of silver coordination polymers Dalton Transactions, 2009, 3162-3174 |
7003745 | CIF | C18 H23.5 B N6.5 Rh | C m c 21 | 10.8148; 10.1274; 33.316 90; 90; 90 | 3649 | Adams, Christopher J.; Anderson, Kirsty M.; Charmant, Jonathan P. H.; Connelly, Neil G.; Field, Bevis A.; Hallett, Andrew J.; Horne, Mathew Solid state and solution structures of rhodium and iridium poly(pyrazolyl)borate diene complexes Dalton Transactions, 2008, 2680-2692 |
7004307 | CIF | C48 H81 B3 Br3 N3 P2 Pt | C m c 21 | 16.8266; 19.4055; 16.4789 90; 90; 90 | 5380.8 | Braunschweig, Holger; Green, Helen; Radacki, Krzysztof; Uttinger, Katharina Synthesis of η1-borazine complexes of palladium and platinum Dalton Transactions, 2008, 3531-3534 |
7008092 | CIF | C31 H39 Al O2 S2 | C m c 21 | 17.001; 17.967; 10.009 90; 90; 90 | 3057.3 | Ma, Haiyan; Melillo, Gianluca; Oliva, Leone; Spaniol, Thomas P.; Englert, Ulli; Okuda, Jun Aluminium alkyl complexes supported by [OSSO] type bisphenolato ligands: synthesis, characterization and living polymerization of rac-lactide. Dalton transactions (Cambridge, England : 2003), 2005, 721-727 |
7009846 | CIF | C16 H24 N4 O2 S Zn | C m c 21 | 11.889; 11.694; 13.953 90; 90; 90 | 1939.9 | Hammes, Brian S.; Carrano, Carl J. Structure and physical properties of several pseudotetrahedral zinc complexes containing a new alkyl thiolate heteroscorpionate ligand Journal of the Chemical Society, Dalton Transactions, 2000, 3304 |
7010537 | CIF | C28 H91 Mo8 N21 Ni3 O45 P V8 | C m c 21 | 14.293; 22.48; 26.103 90; 90; 90 | 8387 | Xu, Yan; Zhu, Dun-Ru; Guo, Zi-Jian; Shi, Yu-Jun; Zhang, Kou-Lin; You, Xiao-Zeng Cation-induced assembly of the first mixed molybdenum‒vanadium hexadecametal host shell cluster anions Journal of the Chemical Society, Dalton Transactions, 2001, 772 |
7011631 | CIF | C15 H4 O11 Ru4 | C m c 21 | 11.337; 13.456; 12.805 90; 90; 90 | 1953.4 | Bruce, Michael I.; Zaitseva, Natasha N.; Skelton, Brian W.; White, Allan H. Synthesis of carbido and related derivatives from calcium carbide and ruthenium carbonyl clusters Journal of the Chemical Society, Dalton Transactions, 2002, 3879 |
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