Crystallography Open Database

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Searching space group like 'C 1 c 1'

COD ID: 1000036
CIF file Formula: - H2 Mg3 O12 Si4 -
Comments: Hendricks, S B; Jefferson, M E Crystal structure of vermiculites and mixed vermiculite-chlorites American Mineralogist 23 (1938) 851-862
Space group: C 1 c 1
Cell volume: 1409.3
Cell parameters: 5.33; 9.18; 28.85; 90; 93.25; 90;  

COD ID: 1000216
CIF file Formula: - Ba Cu F7 Fe -
Comments: Renaudin, J; Calage, Y; Samouel, M; Kozak, A de; Leblanc, M; Ferey, G Complex copper II fluorides. II.- Crystal structure, magnetic properties and Moessbauer study of the partly disordered ferrimagnet BaCuFeF~7~ Revue de Chimie Minerale 22 (1985) 74-87
Space group: C 1 c 1
Cell volume: 527.7
Cell parameters: 10.695; 9.932; 5.654; 90; 118.53; 90;  

COD ID: 1000341
CIF file Formula: - Ba2 F6 O Ti -
Comments: Crosnier, M P; Fourquet, J L Synthesis and crystal structure of a new acentric oxyfluoride: Ba~2~TiOF~6~ Journal of Solid State Chemistry 99 (1992) 355-363
Space group: C 1 c 1
Cell volume: 619.4
Cell parameters: 11.446; 9.304; 7.252; 90; 126.67; 90;  

COD ID: 1000378
CIF file Formula: - Cu0.975 In P2 S6 -
Comments: Maisonneuve, V; Evain, M; Payen, C; Cajipe, V B; Molinie, P Room-temperature crystal structure of the layered phase Cu(I) In(III) P2 S6 Journal of Alloys Compd. 218 (1995) 157-164
Space group: C 1 c 1
Cell volume: 838.5
Cell parameters: 6.0956; 10.5645; 13.623; 90; 107.101; 90;  

COD ID: 1001253
CIF file Formula: - C H17 Co N8 O8 -
Comments: Bernard, M A; Borel, M M; Grandin, A; Leclaire, A Mise en evidence du ligand carbamato synthetise en milieu aqueux. Structure de Co (O C O N H~2~) (N H~3~)~5~ (N O~3~)~2~ Revue de Chimie Minerale 16 (1979) 477-484
Space group: C 1 c 1
Cell volume: 1191.7
Cell parameters: 13.201; 7.813; 12.2; 90; 108.72; 90;  

COD ID: 1001294
CIF file Formula: - As3 Br Cd2 -
Comments: Rebbah, A; Yazbeck, J; Lande, R; Deschanvres, A Etudes structurales et optiques des phases du type Cd~2~ A~3~ X (A = As, P; X = Cl, Br, I) et de leur solution solide Materials Research Bulletin 16 (1981) 525-533
Space group: C 1 c 1
Cell volume: 610.6
Cell parameters: 8.286; 9.408; 7.987; 90; 101.3; 90;  

COD ID: 1001295
CIF file Formula: - Cd2 I P3 -
Comments: Rebbah, A; Yazbeck, J; Lande, R; Deschanvres, A Etudes structurales et optiques des phases du type Cd~2~ A~3~ X (A = As, P; X = Cl, Br, I) et de leur solution solide Materials Research Bulletin 16 (1981) 525-533
Space group: C 1 c 1
Cell volume: 569.8
Cell parameters: 8.243; 9.334; 7.516; 90; 99.8; 90;  

COD ID: 1001296
CIF file Formula: - Br Cd2 P3 -
Comments: Rebbah, A; Yazbeck, J; Lande, R; Deschanvres, A Etudes structurales et optiques des phases du type Cd~2~ A~3~ X (A = As, P; X = Cl, Br, I) et de leur solution solide Materials Research Bulletin 16 (1981) 525-533
Space group: C 1 c 1
Cell volume: 544.1
Cell parameters: 8.077; 9.088; 7.534; 90; 100.3; 90;  

COD ID: 1001297
CIF file Formula: - Cd2 Cl P3 -
Comments: Rebbah, A; Yazbeck, J; Lande, R; Deschanvres, A Etudes structurales et optiques des phases du type Cd~2~ A~3~ X (A = As, P; X = Cl, Br, I) et de leur solution solide Materials Research Bulletin 16 (1981) 525-533
Space group: C 1 c 1
Cell volume: 531.2
Cell parameters: 7.969; 8.984; 7.554; 90; 100.8; 90;  

COD ID: 1001837
CIF file Formula: - As3 Cd2 I -
Comments: Rebbah, A; Leclaire, A; Yazbeck, J; Deschanvres, A Structure de l'iodure de cadmium et d'arsenic Cd2 As3 I Acta Crystallographica B (24,1968-38,1982) 35 (1979) 2197-2199
Space group: C 1 c 1
Cell volume: 632.5
Cell parameters: 8.436; 9.594; 7.952; 90; 100.65; 90;  

COD ID: 1004025
CIF file Formula: - C16 H96 N8 O68 P16 Zn8 -
Comments: Reinert, P.; Zabukovec Logar, N.; Patarin, J.; Kaucic, V. Synthesis and structure of [Zn~8~(HPO~4~)~8~(H~2~PO~4~)~8~] · [(C~2~H~8~N)~8~] · 4H~2~O European Journal of Solid State and Inorganic Chemistry 35(4-5) (1998) 373-387
Space group: C 1 c 1
Cell volume: 1983.3
Cell parameters: 12.645; 10.8477; 14.6311; 90; 98.793; 90;  

COD ID: 1004058
CIF file Formula: - H O9 S2 Tl3 -
Comments: Abraham, F; Nowogrocki, G; Jolibois, B; Laplace, G On Basic Thallium Sulfates: Structure of Tl~2~ Tl OH(SO~4~)~2~ Journal of Solid State Chemistry 47 (1983) 1-5
Space group: C 1 c 1
Cell volume: 870
Cell parameters: 7.758; 17.587; 7.356; 90; 119.91; 90;  

COD ID: 1007048
CIF file Formula: - Cr4 K3 O16 P -
Comments: Averbuch-Pouchot, M T; Durif, A; Guitel, J C Crystal structure of K~3~ P Cr~4~ O~16~: A second example of a quaternary phosphorus Journal of Solid State Chemistry 38 (1981) 253-258
Space group: C 1 c 1
Cell volume: 1581.2
Cell parameters: 9.512; 11.74; 14.74; 90; 106.13; 90;  

COD ID: 1007064
CIF file Formula: - H14 N2 O10 S Te -
Comments: Zilber, R; Durif, A; Averbuch-Pouchot, M T Structure of Ammonium Sulfate Tellurate Te (O H)~6~ (N H~4~)~2~ S O~4~ Acta Crystallographica B (24,1968-38,1982) 37 (1981) 650-652
Space group: C 1 c 1
Cell volume: 995.1
Cell parameters: 13.741; 6.631; 11.405; 90; 106.75; 90;  

COD ID: 1007215
CIF file Formula: - H38 N8 O27 P8 -
Comments: Schuelke, U; Averbuch-Pouchot, M T; Durif, A Preparation and crystal structure of ammonium cyclooctaphosphate trihydrate: (NH~4~)~8~P~8~O~24~ . 3H~2~O Zeitschrift fuer Anorganische und Allgemeine Chemie 619 (1993) 374-380
Space group: C 1 c 1
Cell volume: 3102.1
Cell parameters: 24.268; 6.7; 20.586; 90; 112.06; 90;  

COD ID: 1007242
CIF file Formula: - Cu K2 O12 P4 -
Comments: Laugt, M; Durif, A Etude systematique des phosphates condenses Seminaire de Chimie de l'Etat Solide 1971-72 1972 (1972) 157-175
Space group: C 1 c 1
Cell volume: 1041.6
Cell parameters: 10.94; 12.25; 7.904; 90; 100.49; 90;  

COD ID: 1008019
CIF file Formula: - Cd H10 N Na O10 P2 -
Comments: Averbuch-Pouchot, M T; Guitel, J C Donnees cristallochimiques sur deux nouveaux diphosphates mixtes, Ca N H~4~ Na P~2~ O~7~ (H~2~ O)~3~ et Cd N H~4~ Na P~2~ O~7~ (H~2~ O)~3~ et structure cristalline de Cd N H~4~ Na P~2~ O~7~ (H~2~ O)~3~ Acta Crystallographica B (24,1968-38,1982) 33 (1977) 3460-3462
Space group: C 1 c 1
Cell volume: 925.1
Cell parameters: 10.211; 16.56; 5.632; 90; 103.73; 90;  

COD ID: 1008173
CIF file Formula: - Cr4 O16 P Rb3 -
Comments: Averbuch-Pouchot, M T Crystal data for Rb~3~ Cr~4~ P O~16~ and Rb~3~ Cr~4~ As O~16~ Zeitschrift fuer Kristallographie (149,1979-) 155 (1981) 315-317
Space group: C 1 c 1
Cell volume: 1666.3
Cell parameters: 9.712; 11.98; 14.9; 90; 106.02; 90;  

COD ID: 1008174
CIF file Formula: - As Cr4 O16 Rb3 -
Comments: Averbuch-Pouchot, M T Crystal data for Rb~3~ Cr~4~ P O~16~ and Rb~3~ Cr~4~ As O~16~ Zeitschrift fuer Kristallographie (149,1979-) 155 (1981) 315-317
Space group: C 1 c 1
Cell volume: 1682.4
Cell parameters: 9.804; 11.96; 14.92; 90; 105.91; 90;  

COD ID: 1011045
CIF file Formula: - Al2 H4 O9 Si2 -
Comments: Gruner, W J The Crystal Structure of Kaolinite Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 83 (1932) 75-88
Space group: C 1 c 1
Cell volume: 656.9
Cell parameters: 5.148; 8.92; 14.535; 90; 100.2; 90;  

COD ID: 1011062
CIF file Formula: - Al2 H4 O9 Si2 -
Comments: Hendricks, S B The Crystal Structure of Nacrite Al2 O3 * 2Si O2 * 2H2 O and the Polymorphism of the Kaolin Minerals. Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 100 (1939) 509-518
Space group: C 1 c 1
Cell volume: 1975.9
Cell parameters: 8.94; 5.14; 43; 90; 90.33; 90;  

COD ID: 1011080
CIF file Formula: - Al2 H4 O9 Si2 -
Comments: Gruner, J W The crystal structure of Nacrite and a comparison of certain optical properties of the caolin group with its structures Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 85 (1933) 345-354
Space group: C 1 c 1
Cell volume: 1320
Cell parameters: 5.16; 8.93; 28.65999; 90; 91.72; 90;  

COD ID: 1100128
CIF file Formula: - C2 F2 Na3 O6 Yb -
Comments: Ben Ali, A.; Maisonneuve, V.; Leblanc, M. Phase stability regions in the (Na2 C O3) - (Yb F3) - (H2 O) system at 190 C. Crystal structures of two new fluoride carbonates, Na2 Yb (C O3)2 F and Na3 Yb (C O3)2 F2 Solid State Sciences 4(11-12) (2002) 1367-1375
Space group: C 1 c 1
Cell volume: 1359.54
Cell parameters: 7.127; 29.816; 6.928; 90; 112.56; 90;  

COD ID: 1100349
CIF file Formula: - C28 H44 Li O4 Si -
Comments: Boche, Gernot; Opel, Achim; Marsch, Michael; Harms, Klaus; Hallera, Friederike; Lohrenz, John C. W.; Thümmler, Christina; Koch, Wolfram α-Oxygen-Substituted Organolithium Compounds and Their Carbenoid Nature: Calculations of the Configurational Stability and of LiCH~2~OH Model Structures, Crystal Structure of Diphenyl(trimethylsilyloxy)methyllithium · 3 THF, and the Stereochemistry of the (Reverse) Brook Rearrangement Chemische Berichte 125(10) (1992) 2265-2273
Space group: C 1 c 1
Cell volume: 2828.04
Cell parameters: 15.3; 10.13; 19.369; 90; 109.6; 90;  

COD ID: 1100373
CIF file Formula: - C30 H40 Br2 Mg O4 -
Comments: Boche, Gernot; Harms, Klaus; Marsch, Michael; Müller, Achim 9-Bromo-9-[(bromomagnesium)methylene]fluorene‒tetrahydrofuran (1/4) structure of a MgBr/Br carbenoid Journal of the Chemical Society, Chemical Communications (issue 11) (1994) 1393-1394
Space group: C 1 c 1
Cell volume: 3043.89
Cell parameters: 9.29; 19.368; 17.159; 90; 99.63; 90;  

COD ID: 1100485
CIF file Formula: - C18 H42 Cl3 N2 Nb P2 -
Comments: Philipp, G.; Harms, K.; Dehnicke, K.; Maichle-Mössmer, C.; Abram, U. Phosphaniminato-Komplexe von Niob und Tantal. Die Kristallstrukturen von [NbCl~4~(NPiPr~3~)(CH~3~CN)], [NbCl~3~(NPiPr~3~)~2~], [TaCl~4~(NPiPr~3~)]~2~ und [TaCl~3~(NPiPr~3~)~2~] Zeitschrift fuer Anorganische und Allgemeine Chemie 622(11) (1996) 1927-1934
Space group: C 1 c 1
Cell volume: 2674.61
Cell parameters: 13.027; 13.217; 16.72; 90; 111.71; 90;  

COD ID: 1100487
CIF file Formula: - C18 H42 Cl3 N2 P2 Ta -
Comments: Philipp, G.; Harms, K.; Dehnicke, K.; Maichle-Mössmer, C.; Abram, U. Phosphaniminato-Komplexe von Niob und Tantal. Die Kristallstrukturen von [NbCl~4~(NPiPr~3~)(CH~3~CN)], [NbCl~3~(NPiPr~3~)~2~], [TaCl~4~(NPiPr~3~)]~2~ und [TaCl~3~(NPiPr~3~)~2~] Zeitschrift fuer Anorganische und Allgemeine Chemie 622(11) (1996) 1927-1934
Space group: C 1 c 1
Cell volume: 2700.49
Cell parameters: 13.039; 13.272; 16.821; 90; 111.92; 90;  

COD ID: 1100706
CIF file Formula: - H2 In O14 Rb3 Si5 -
Comments: Ling-I Hung; Sue-Lein Wang; Chia-Yi Chen; Bor-Chen Chang; Kwang-Hwa Lii Rb3In(H2O)Si5O13: A Novel Indium Silicate with a CdSO4-Topological-Type Structure Inorganic Chemistry 44 (2005) 2992-2994
Space group: C 1 c 1
Cell volume: 1424.85
Cell parameters: 9.0697; 11.5456; 13.9266; 90; 102.3; 90;  

COD ID: 1100942
CIF file Formula: - C28.5 H21.25 Cl3 N6.75 O14 Ru -
Comments: Nripen Chanda; Debamita Paul; Sanjib Kar; Shaikh M. Mobin; Anindya Datta; Vedavati G. Puranik; K. Krishnamurthy Rao; Goutam Kumar Lahiri Effect of 2-(2-Pyridyl)azole-Based Ancillary Ligands (L1-4) on the Electrophilicity of the Nitrosyl Function in [RuII(trpy)(L1-4)(NO)]3+ [trpy = 2,2':6',2''-Terpyridine]. Synthesis, Structures, and Spectroscopic, Electrochemical, and Kinetic Aspects Inorganic Chemistry 44 (2005) 3499-3511
Space group: C 1 c 1
Cell volume: 6858.3
Cell parameters: 21.1704; 30.04; 14.8373; 90; 133.379; 90;  

COD ID: 1100978
CIF file Formula: - C8 H10 Cd I2 N4 -
Comments: Ruili Sang; Li Xu A Series of Single, Double, and Triple Me2biim-Bridged Dinuclear, Trinuclear, and Polymeric Complexes: Syntheses, Crystal Structures, and Luminescent Properties Inorganic Chemistry 44 (2005) 3731-3737
Space group: C 1 c 1
Cell volume: 1321.5
Cell parameters: 5.3546; 15.7642; 15.773; 90; 96.989; 90;  

COD ID: 1101060
CIF file Formula: - C5 H4 Ag Cl N4 O5 -
Comments: Mohammad Abul Haj; Miguel Quirós; Juan M. Salas; René Faure Silver complexes with triazolopyrimidine ligands containing an exocyclic oxygen atom: X-ray evidence for an unusual tautomeric form. Dalton Transactions (2001) 1798-1801
Space group: C 1 c 1
Cell volume: 951.3
Cell parameters: 6.6046; 14.487; 9.9594; 90; 93.379; 90;  

COD ID: 1501855
CIF file Formula: - C17 H18 N2 O2 -
Comments: Bigot, Aurélien; Blythe, Judith; Pandya, Chirag; Wagner, Trixie; Loiseleur, Olivier DAST-mediated cyclization of α,α-disubstituted-α-acylaminoketones: efficient and divergent synthesis of unprecedented heterocycles. Organic letters 13(2) (2011) 192-195
Space group: C 1 c 1
Cell volume: 1441.5
Cell parameters: 8.782; 19.177; 9.362; 90; 113.9; 90;  

COD ID: 1501879
CIF file Formula: - C28 H29 N3 O3 -
Comments: Scadeng, Owen; Ferguson, Michael J.; West, F. G. Intermolecular [3 + 3]-cycloadditions of azides with the Nazarov intermediate. Organic letters 13(1) (2011) 114-117
Space group: C 1 c 1
Cell volume: 2399
Cell parameters: 16.7182; 15.0048; 9.8096; 90; 102.86; 90;  

COD ID: 1501946
CIF file Formula: - C57 H54 N O6 P -
Comments: Yin, Guangwei; Zhu, Yuanxun; Zhang, Li; Lu, Ping; Wang, Yanguang Preparation of allenephosphoramide and its utility in the preparation of 4,9-dihydro-2h-benzo[f]isoindoles. Organic letters 13(5) (2011) 940-943
Space group: C 1 c 1
Cell volume: 4769
Cell parameters: 18.5397; 15.0248; 17.6084; 90; 103.518; 90;  

COD ID: 1501974
CIF file Formula: - C21 H20 Br N O3 -
Comments: Deb, Indubhusan; Das, Deepankar; Seidel, Daniel Redox isomerization via azomethine ylide intermediates: N-alkyl indoles from indolines and aldehydes. Organic letters 13(4) (2011) 812-815
Space group: C 1 c 1
Cell volume: 1771.96
Cell parameters: 20.2038; 5.1569; 18.62; 90; 114.023; 90;  

COD ID: 1502001
CIF file Formula: - C24 H24 N2 O -
Comments: Zhang, Shaoguang; Zhao, Jing; Zhang, Wen-Xiong; Xi, Zhenfeng One-pot synthesis of pyrrolo[3,2-d]pyridazines and pyrrole-2,3-diones via zirconocene-mediated four-component coupling of Si-tethered diyne, nitriles, and azide. Organic letters 13(7) (2011) 1626-1629
Space group: C 1 c 1
Cell volume: 2008.8
Cell parameters: 12.118; 13.959; 12.467; 90; 107.72; 90;  

COD ID: 1502144
CIF file Formula: - C22 H17 N O -
Comments: Ren, Hui; Luo, Yong; Ye, Shengqing; Wu, Jie Silver triflate catalyzed reaction of 2-alkynylbenzaldoxime with aryne. Organic letters 13(10) (2011) 2552-2555
Space group: C 1 c 1
Cell volume: 1640
Cell parameters: 5.997; 19.04; 14.366; 90; 90.985; 90;  

COD ID: 1502242
CIF file Formula: - C20 H23 N O3 -
Comments: Bhat, Vikram; Mackay, James A.; Rawal, Viresh H. Directed oxidative cyclizations to C2- or C4-positions of indole: efficient construction of the bicyclo[4.3.1]decane core of welwitindolinones. Organic letters 13(12) (2011) 3214-3217
Space group: C 1 c 1
Cell volume: 1639.8
Cell parameters: 10.639; 15.23; 10.594; 90; 107.204; 90;  

COD ID: 1502247
CIF file Formula: - C14 H12 B F2 N O2 -
Comments: Frath, Denis; Azizi, Sébastien; Ulrich, Gilles; Retailleau, Pascal; Ziessel, Raymond Facile synthesis of highly fluorescent Boranil complexes. Organic letters 13(13) (2011) 3414-3417
Space group: C 1 c 1
Cell volume: 1293.9
Cell parameters: 18.698; 6.3535; 13.0976; 90; 123.74; 90;  

COD ID: 1502417
CIF file Formula: - C16 H23 N O5 -
Comments: Cui, Sunliang; Wojtas, Lukasz; Antilla, Jon C. Pd-catalyzed C4-olefination of oxazoles via C-H bond activation: divergent synthesis of functionalized amino alcohol and amino acid derivatives. Organic letters 13(19) (2011) 5040-5043
Space group: C 1 c 1
Cell volume: 1569.03
Cell parameters: 14.7468; 5.0698; 21.3719; 90; 100.896; 90;  

COD ID: 1502439
CIF file Formula: - C32 H25 F O4 -
Comments: Fang, Xinqiang; Chen, Xingkuan; Chi, Yonggui Robin Enantioselective Diels-Alder reactions of enals and alkylidene diketones catalyzed by N-heterocyclic carbenes. Organic letters 13(17) (2011) 4708-4711
Space group: C 1 c 1
Cell volume: 2490.7
Cell parameters: 25.2131; 10.2122; 9.6812; 90; 92.312; 90;  

COD ID: 1502592
CIF file Formula: - C13 H18 I N O2 -
Comments: Tasker, Sarah Z.; Brandsen, Benjamin M.; Ryu, Keun Ah; Snapper, Gregory S.; Staples, Richard J.; DeKock, Roger L.; Anderson, Carolyn E. Synthesis of a new class of β-iodo N-alkenyl 2-pyridones. Organic letters 13(23) (2011) 6224-6227
Space group: C 1 c 1
Cell volume: 1425.06
Cell parameters: 6.8234; 22.6101; 9.6941; 90; 107.665; 90;  

COD ID: 1502703
CIF file Formula: - F N3 O2 S -
Comments: Zeng, Xiaoqing; Gerken, Michael; Beckers, Helmut; Willner, Helge Anomeric effects in sulfonyl compounds: an experimental and computational study of fluorosulfonyl azide, FSO(2)N(3), and trifluoromethylsulfonyl azide, CF(3)SO(2)N(3). The journal of physical chemistry. A 114(28) (2010) 7624-7630
Space group: C 1 c 1
Cell volume: 405.27
Cell parameters: 7.0017; 13.5124; 5.017; 90; 121.37; 90;  

COD ID: 1502780
CIF file Formula: - C41 H39 Br Ir N3 -
Comments: Yan, Qifan; Yue, Kan; Yu, Chao; Zhao, Dahui Oligo- and Polyfluorene-Tetheredfac-Ir(ppy)3: Substitution Effects Macromolecules 43(20) (2010) 8479
Space group: C 1 c 1
Cell volume: 3433.7
Cell parameters: 11.597; 19.586; 15.383; 90; 100.67; 90;  

COD ID: 1502858
CIF file Formula: - C12 H19 N O2 -
Comments: Meyer, Angelica M.; Katz, Christopher E.; Li, Sze-Wan; Vander Velde, David; Aubé, Jeffrey A tandem Prins/Schmidt reaction approach to marine alkaloids: formal and total syntheses of lepadiformines A and C. Organic letters 12(6) (2010) 1244-1247
Space group: C 1 c 1
Cell volume: 1030.8
Cell parameters: 15.0518; 7.8121; 10.9784; 90; 127.009; 90;  

COD ID: 1502938
CIF file Formula: - C30 H24 Cl N O2 -
Comments: Yu, Xiuzhao; Du, Bo; Wang, Kai; Zhang, Junliang Highly substituted 2,3-dihydroisoxazoles by Et(3)N-catalyzed tandem reaction of electron-deficient 1,3-conjugated enynes with hydroxylamines. Organic letters 12(8) (2010) 1876-1879
Space group: C 1 c 1
Cell volume: 2451
Cell parameters: 5.5972; 22.0274; 19.8862; 90; 91.438; 90;  

COD ID: 1502967
CIF file Formula: - C14 H17 N O P -
Comments: Ackermann, Lutz; Kapdi, Anant R.; Schulzke, Carola Air-stable secondary phosphine oxide or chloride (Pre)ligands for cross-couplings of unactivated alkyl chlorides. Organic letters 12(10) (2010) 2298-2301
Space group: C 1 c 1
Cell volume: 1344.7
Cell parameters: 9.0672; 21.933; 7.2346; 90; 110.83; 90;  

COD ID: 1503022
CIF file Formula: - C30 H29 N -
Comments: Wang, Yuxing; Liao, Qian; Xi, Chanjuan Copper-catalyzed amination of alkenyl halides: efficient method for the synthesis of enamines. Organic letters 12(13) (2010) 2951-2953
Space group: C 1 c 1
Cell volume: 2328.7
Cell parameters: 18.025; 12.343; 12.143; 90; 120.46; 90;  

COD ID: 1503393
CIF file Formula: - C92 H66 -
Comments: Gagnon, Eric; Rochefort, Alain; Métivaud, Valérie; Wuest, James D. Hexaphenylbenzenes as potential acetylene sponges. Organic letters 12(2) (2010) 380-383
Space group: C 1 c 1
Cell volume: 6401.4
Cell parameters: 12.3608; 45.744; 11.5273; 90; 100.85; 90;  

COD ID: 1503546
CIF file Formula: - C66 H100 Cl2 N12 O8 -
Comments: Wu, Biao; Jia, Chuandong; Wang, Xiaolei; Li, Shaoguang; Huang, Xiaojuan; Yang, Xiao-Juan Chloride coordination by oligoureas: from mononuclear crescents to dinuclear foldamers. Organic letters 14(3) (2012) 684-687
Space group: C 1 c 1
Cell volume: 6822.6
Cell parameters: 19.8924; 18.594; 18.4455; 90; 90.145; 90;  

COD ID: 1503790
CIF file Formula: - C58 H72 O18 S4 -
Comments: Geng, Mingwei; Zhang, Dechun; Wu, Xiangxiang; He, Lan; Gong, Bing One-pot formation and characterization of macrocyclic aromatic tetrasulfonates. Organic letters 11(4) (2009) 923-926
Space group: C 1 c 1
Cell volume: 6033
Cell parameters: 12.171; 29.543; 17.148; 90; 101.92; 90;  

COD ID: 1503918
CIF file Formula: - C14 H27 N3 O4 Os -
Comments: Donohoe, Timothy J.; Callens, Cedric K. A.; Thompson, Amber L. Tethered aminohydroxylation (TA) reaction of amides. Organic letters 11(11) (2009) 2305-2307
Space group: C 1 c 1
Cell volume: 1637.98
Cell parameters: 11.2229; 22.1408; 7.3452; 90; 116.176; 90;  

COD ID: 1503987
CIF file Formula: - C18 H19 N O5 -
Comments: Tang, Yuchen; Fettinger, James C.; Shaw, Jared T. One-step synthesis of complex nitrogen heterocycles from imines and alkyl-substituted maleic anhydrides. Organic letters 11(17) (2009) 3802-3805
Space group: C 1 c 1
Cell volume: 1540.1
Cell parameters: 12.049; 15.856; 8.11; 90; 96.293; 90;  

COD ID: 1504021
CIF file Formula: - C24 H30 O3 -
Comments: Saadi, Jakub; Lentz, Dieter; Reissig, Hans-Ulrich Medium-sized carbocycles by samarium diiodide-induced carbonyl-alkene cyclizations. Organic letters 11(15) (2009) 3334-3337
Space group: C 1 c 1
Cell volume: 1995.8
Cell parameters: 8.4941; 15.472; 15.68; 90; 104.415; 90;  

COD ID: 1504147
CIF file Formula: - C18 H19 N O5 -
Comments: Barabé, Francis; Bétournay, Geneviève; Bellavance, Gabriel; Barriault, Louis Gold-catalyzed synthesis of carbon-bridged medium-sized rings. Organic letters 11(18) (2009) 4236-4238
Space group: C 1 c 1
Cell volume: 1613
Cell parameters: 14.725; 16.2; 6.768; 90; 91.991; 90;  

COD ID: 1504431
CIF file Formula: - C35 H63 Ca N3 O2 Si2 -
Comments: Darensbourg, Donald J.; Choi, Wonsook; Karroonnirun, Osit; Bhuvanesh, Nattamai Ring-Opening Polymerization of Cyclic Monomers by Complexes Derived from Biocompatible Metals. Production of Poly(lactide), Poly(trimethylene carbonate), and Their Copolymers Macromolecules 41(10) (2008) 3493
Space group: C 1 c 1
Cell volume: 3948.5
Cell parameters: 21.7989; 10.4434; 17.3961; 90; 94.427; 90;  

COD ID: 1504578
CIF file Formula: - C18 H26 O4 -
Comments: Wang, Qiaoling; Chen, Chuo An approach to the core skeleton of lancifodilactone F. Organic letters 10(6) (2008) 1223-1226
Space group: C 1 c 1
Cell volume: 1552.7
Cell parameters: 7.321; 13.267; 16.259; 90; 100.517; 90;  

COD ID: 1504964
CIF file Formula: - C24 H21 N3 O -
Comments: Liu, Yuxiu; Yan, Wuming; Chen, Yunfeng; Petersen, Jeffrey L.; Shi, Xiaodong Efficient synthesis of N-2-aryl-1,2,3-triazole fluorophores via post-triazole arylation. Organic letters 10(23) (2008) 5389-5392
Space group: C 1 c 1
Cell volume: 1994.2
Cell parameters: 10.1475; 15.3555; 13.0042; 90; 100.217; 90;  

COD ID: 1505045
CIF file Formula: - C26 H16 -
Comments: Tong, H.; Dong, Y.; Hong, Y.; Haussler, M.; Lam, J.W.Y.; Sung, H.H.-Y.; Yu, X.; Sun, J.; Williams, I.D.; Kwok, H.S.; Tang, B.Z. Aggregation-Induced Emission: Effects of Molecular Structure, Solid-State Conformation, and Morphological Packing Arrangement on Light-Emitting Behaviors of Diphenyldibenzofulvene Derivatives Journal of Physical Chemistry C 111(5) (2007) 2287
Space group: C 1 c 1
Cell volume: 1650.22
Cell parameters: 11.9998; 18.2129; 7.9427; 90; 108.075; 90;  

COD ID: 1505121
CIF file Formula: - C22 H23 Al Cl4 N2 O3 -
Comments: Du, Hongzhi; Pang, Xuan; Yu, Haiyang; Zhuang, Xiuli; Chen, Xuesi; Cui, Dongmei; Wang, Xianhong; Jing, Xiabin Polymerization ofrac-Lactide Using Schiff Base Aluminum Catalysts: Structure, Activity, and Stereoselectivity Macromolecules 40(6) (2007) 1904
Space group: C 1 c 1
Cell volume: 4883.9
Cell parameters: 13.7448; 17.259; 21.561; 90; 107.278; 90;  

COD ID: 1505198
CIF file Formula: - C19 H15 N3 O -
Comments: Bis, Joanna A.; Vishweshwar, Peddy; Weyna, David; Zaworotko, Michael J. Hierarchy of Supramolecular Synthons: Persistent Hydroxyl···Pyridine Hydrogen Bonds in Cocrystals That Contain a Cyano Acceptor Molecular Pharmaceutics 4(3) (2007) 401
Space group: C 1 c 1
Cell volume: 3047.5
Cell parameters: 18.503; 7.5019; 21.971; 90; 92.181; 90;  

COD ID: 1505293
CIF file Formula: - C18 H13 Cl -
Comments: Su, Weike; Jin, Can First catalytic and green synthesis of aryl-(Z)-vinyl chlorides and its plausible addition-elimination mechanism. Organic letters 9(6) (2007) 993-996
Space group: C 1 c 1
Cell volume: 1328
Cell parameters: 28.966; 6.2068; 7.5794; 90; 102.961; 90;  

COD ID: 1505597
CIF file Formula: - C15 H17 Cl2 N O -
Comments: Bissember, Alex C.; Phillis, Andrew T.; Banwell, Martin G.; Willis, Anthony C. Base-promoted reactions of dichlorocarbene adducts of cyclic enamines: a new route to annulated pyrroles. Organic letters 9(26) (2007) 5421-5424
Space group: C 1 c 1
Cell volume: 1408.14
Cell parameters: 15.5984; 13.5175; 6.6823; 90; 91.9718; 90;  

COD ID: 1505635
CIF file Formula: - C16 H18 N2 O2 -
Comments: Ribelin, Timothy P.; Judd, Andrew S.; Akritopoulou-Zanze, Irini; Henry, Rodger F.; Cross, Jeffrey L.; Whittern, David N.; Djuric, Stevan W. Concise construction of novel bridged bicyclic lactams by sequenced Ugi/RCM/Heck reactions. Organic letters 9(24) (2007) 5119-5122
Space group: C 1 c 1
Cell volume: 1410
Cell parameters: 8.479; 22.03; 8.403; 90; 116.06; 90;  

COD ID: 1505640
CIF file Formula: - C44.5 H40.5 Cl1.5 P2 -
Comments: Doherty, Simon; Knight, Julian G.; Smyth, Catherine H.; Harrington, Ross W.; Clegg, William Rhodium-catalyzed double [2 + 2 + 2] cycloaddition of 1,4-bis(diphenylphosphinoyl)buta-1,3-diyne with tethered diynes: a modular, highly versatile single-pot synthesis of NU-BIPHEP biaryl diphosphines. Organic letters 9(23) (2007) 4925-4928
Space group: C 1 c 1
Cell volume: 7408.9
Cell parameters: 10.4452; 26.656; 26.723; 90; 95.279; 90;  

COD ID: 1505652
CIF file Formula: - C14 H18 F3 N O3 S2 -
Comments: Murai, Toshiaki; Fukushima, Kozue; Mutoh, Yuichiro Synthesis and properties of 1-methylthiopropargylammonium salts and their use as key precursors to sulfur-containing enediynes. Organic letters 9(25) (2007) 5295-5298
Space group: C 1 c 1
Cell volume: 1712.4
Cell parameters: 6.2538; 29.083; 9.86; 90; 107.277; 90;  

COD ID: 1506146
CIF file Formula: - C18 H28 O4 -
Comments: Crawford, Claire; Nelson, Adam; Patel, Ian Development of an approach to the synthesis of the ABC ring system of Hemibrevetoxin B. Organic letters 8(19) (2006) 4231-4234
Space group: C 1 c 1
Cell volume: 1718.01
Cell parameters: 20.8896; 8.0132; 11.049; 90; 111.737; 90;  

COD ID: 1506151
CIF file Formula: - C20 H26 N2 O6 -
Comments: Nilson, Mark G.; Funk, Raymond L. Generation of N-acyliminium ions via intramolecular conjugate addition reactions: a strategy for the total synthesis of nakadomarin A. Organic letters 8(17) (2006) 3833-3836
Space group: C 1 c 1
Cell volume: 2030.5
Cell parameters: 18.465; 9.25; 12.676; 90; 110.308; 90;  

COD ID: 1506217
CIF file Formula: - C16 H13 Fe I -
Comments: Chebny, Vincent J.; Dhar, Dwairath; Lindeman, Sergey V.; Rathore, Rajendra Simultaneous ejection of six electrons at a constant potential by hexakis(4-ferrocenylphenyl)benzene. Organic letters 8(22) (2006) 5041-5044
Space group: C 1 c 1
Cell volume: 2729.36
Cell parameters: 7.8618; 23.0451; 15.497; 90; 103.565; 90;  

COD ID: 1506260
CIF file Formula: - C88 H118 N4 O24 -
Comments: Zhang, Aimin; Ferguson, Joseph S.; Yamato, Kazuhiro; Zheng, Chong; Gong, Bing Improving foldamer synthesis through protecting group induced unfolding of aromatic oligoamides. Organic letters 8(22) (2006) 5117-5120
Space group: C 1 c 1
Cell volume: 8697.4
Cell parameters: 19.514; 16.3891; 27.727; 90; 101.243; 90;  

COD ID: 1506345
CIF file Formula: - C30 H32 Cl3 N8 O2 Ru -
Comments: Jakupec, Michael A.; Reisner, Erwin; Eichinger, Anna; Pongratz, Martina; Arion, Vladimir B.; Galanski, Markus; Hartinger, Christian G.; Keppler, Bernhard K. Redox-active antineoplastic ruthenium complexes with indazole: correlation of in vitro potency and reduction potential. Journal of medicinal chemistry 48(8) (2005) 2831-2837
Space group: C 1 c 1
Cell volume: 3202.4
Cell parameters: 17.681; 11.082; 16.738; 90; 102.46; 90;  

COD ID: 1506389
CIF file Formula: - C3 H7 Al3 N O13 P3 -
Comments: Paillaud, Jean-Louis; Marichal, Claire; Roux, Mélanie; Baerlocher, Christian; Chézeau, Jean Michel Tripling of the unit cell volume of the non-centrosymmetric AlPO4-SOD after dehydration: a structural study of a reversible process. The journal of physical chemistry. B 109(24) (2005) 11893-11899
Space group: C 1 c 1
Cell volume: 4213.64
Cell parameters: 12.8203; 12.18269; 26.99238; 90; 91.843; 90;  

COD ID: 1506774
CIF file Formula: - C24 H33 N O4 -
Comments: Sales, Marcelo; Charette, André B A Diels-Alder approach to the stereoselective synthesis of 2,3,5,6-tetra- and 2,3,4,5,6-pentasubstituted piperidines. Organic letters 7(26) (2005) 5773-5776
Space group: C 1 c 1
Cell volume: 2227.7
Cell parameters: 10.685; 24.806; 8.872; 90; 108.68; 90;  

COD ID: 1506903
CIF file Formula: - C22 H19 N3 O3 -
Comments: Lovely, Carl J.; Du, Hongwang; He, Yong; Rasika Dias, H. V. Oxidative rearrangement of imidazoles with dimethyldioxirane. Organic letters 6(5) (2004) 735-738
Space group: C 1 c 1
Cell volume: 1851.7
Cell parameters: 16.9447; 10.3611; 12.0903; 90; 119.267; 90;  

COD ID: 1507013
CIF file Formula: - C22 H16 N2 O2 -
Comments: Shotwell, Sandra; Windscheif, Paul M.; Smith, Mark D.; Bunz, Uwe H. F. Pyridine-capped, oligomeric (o-phenyleneethynylene)s. Organic letters 6(23) (2004) 4151-4154
Space group: C 1 c 1
Cell volume: 1738.6
Cell parameters: 7.8878; 26.234; 8.5049; 90; 98.916; 90;  

COD ID: 1507102
CIF file Formula: - C12 H20 O2 -
Comments: Howells, Dean M.; Barker, Sarah M.; Watson, Faye C.; Light, Mark E.; Hursthouse, Michael B.; Kilburn, Jeremy D. Samarium diiodide coupling of enones: a remarkable cascade sequence. Organic letters 6(12) (2004) 1943-1945
Space group: C 1 c 1
Cell volume: 2160.4
Cell parameters: 22.1999; 5.9517; 16.3776; 90; 93.251; 90;  

COD ID: 1507250
CIF file Formula: - C17 H17 N O5 -
Comments: Bode, Jeffrey W.; Hachisu, Yoshifumi; Matsuura, Tomoo; Suzuki, Keisuke Facile construction and divergent transformation of polycyclic isoxazoles: direct access to polyketide architectures. Organic letters 5(4) (2003) 391-394
Space group: C 1 c 1
Cell volume: 1510.9
Cell parameters: 11.7495; 15.552; 8.5599; 90; 104.998; 90;  

COD ID: 1507289
CIF file Formula: - C26 H26 O4 -
Comments: Ma, Shengming; Yu, Zhanqian Efficient synthesis of bibutenolide derivatives through oxidative dimeric cyclization-coupling reaction of 2,3-allenoic acids. Organic letters 5(9) (2003) 1507-1510
Space group: C 1 c 1
Cell volume: 2238.5
Cell parameters: 12.2918; 14.5009; 12.6441; 90; 96.671; 90;  

COD ID: 1507300
CIF file Formula: - C22 H25 N O5 S -
Comments: Sun, Pei-Pei; Chang, Meng-Yang; Chiang, Michael Y.; Chang, Nein-Chen A facile route to polysubstitutedN-benzyl pyroglutamates. Organic letters 5(10) (2003) 1761-1763
Space group: C 1 c 1
Cell volume: 2174.9
Cell parameters: 21.192; 10.971; 10.128; 90; 112.54; 90;  

COD ID: 1507363
CIF file Formula: - C21 H26 N4 O5 S -
Comments: He, Yong; Chen, Yingzhong; Wu, Haiyan; Lovely, Carl J. Intramolecular Diels-Alder reactions of 4-vinylimidazoles. Organic letters 5(20) (2003) 3623-3626
Space group: C 1 c 1
Cell volume: 2250
Cell parameters: 20.531; 11.646; 9.616; 90; 101.88; 90;  

COD ID: 1507586
CIF file Formula: - C16 H17 Br2 N O5 -
Comments: Hernández-Torres, Gloria; Tan, Bin; Barbas, 3rd, Carlos F Organocatalysis as a safe practical method for the stereospecific dibromination of unsaturated compounds. Organic letters 14(7) (2012) 1858-1861
Space group: C 1 c 1
Cell volume: 1760.27
Cell parameters: 10.5664; 14.0387; 11.8735; 90; 91.954; 90;  

COD ID: 1507677
CIF file Formula: - C52 H58 B F4 N3 O10 -
Comments: Noujeim, Nadim; Zhu, Kelong; Vukotic, V. Nicholas; Loeb, Stephen J. [2]Pseudorotaxanes from T-shaped benzimidazolium axles and [24]crown-8 wheels. Organic letters 14(10) (2012) 2484-2487
Space group: C 1 c 1
Cell volume: 4955.2
Cell parameters: 11.7513; 29.638; 15.2776; 90; 111.368; 90;  

COD ID: 1507753
CIF file Formula: - C19 H25 N O4 -
Comments: Fujino, Daishi; Yorimitsu, Hideki; Osuka, Atsuhiro Synthesis of 1,2-Disubstituted Cyclopentenes by Palladium-Catalyzed Reaction of Homopropargyl-Substituted Dicarbonyl Compounds with Organic Halides via 5-Endo-Dig Cyclization. Organic letters 14(11) (2012) 2914-2917
Space group: C 1 c 1
Cell volume: 1745.85
Cell parameters: 13.2027; 17.3219; 7.9128; 90; 105.257; 90;  

COD ID: 1507929
CIF file Formula: - C33 H26 Cl2 O6 S2 -
Comments: Seyedsayamdost, Mohammad R.; Case, Rebecca J.; Kolter, Roberto; Clardy, Jon The Jekyll-and-Hyde chemistry of Phaeobacter gallaeciensis. Nature chemistry 3(4) (2011) 331-335
Space group: C 1 c 1
Cell volume: 1565.7
Cell parameters: 14.755; 14.831; 7.1877; 90; 95.469; 90;  

COD ID: 1508100
CIF file Formula: - C84 H64 F24 N4 P4 S24 -
Comments: Spruell, Jason M.; Coskun, Ali; Friedman, Douglas C.; Forgan, Ross S.; Sarjeant, Amy A.; Trabolsi, Ali; Fahrenbach, Albert C.; Barin, Gokhan; Paxton, Walter F.; Dey, Sanjeev K.; Olson, Mark A.; Benítez, Diego; Tkatchouk, Ekaterina; Colvin, Michael T.; Carmielli, Raanan; Caldwell, Stuart T.; Rosair, Georgina M.; Hewage, Shanika Gunatilaka; Duclairoir, Florence; Seymour, Jennifer L.; Slawin, Alexandra M. Z.; Goddard, 3rd, William A; Wasielewski, Michael R.; Cooke, Graeme; Stoddart, J. Fraser Highly stable tetrathiafulvalene radical dimers in [3]catenanes. Nature chemistry 2(10) (2010) 870-879
Space group: C 1 c 1
Cell volume: 9839
Cell parameters: 28.643; 14.21; 24.502; 90; 99.38; 90;  

COD ID: 1508149
CIF file Formula: - C87 H86 Li2 N17 O2 U -
Comments: Arnold, Polly L.; Pécharman, Anne-Frédérique; Hollis, Emmalina; Yahia, Ahmed; Maron, Laurent; Parsons, Simon; Love, Jason B. Uranyl oxo activation and functionalization by metal cation coordination. Nature chemistry 2(12) (2010) 1056-1061
Space group: C 1 c 1
Cell volume: 7786.7
Cell parameters: 14.0928; 24.2786; 22.7601; 90; 90.769; 90;  

COD ID: 1508215
CIF file Formula: - C22 H21 B2 N O3 -
Comments: Riveraa, Jose Maria; Mendeza, Enrique; Colorado-Peraltab, Raul; Rinconc, Susana; Farfanb, Norberto; Santillan, Rosa Synthesis, characterization and X-ray studies of new six-seven membered rings [4.5.0] heterobicyclic system of monomeric boronates Inorganica Chimica Acta 390 (2012) 26-32
Space group: C 1 c 1
Cell volume: 1964.98
Cell parameters: 14.86; 14.401; 10.894; 90; 122.556; 90;  

COD ID: 1508500
CIF file Formula: - C3 H5 N3 O4 -
Comments: Laus, Gerhard; Kahlenberg, Volker Crystal Structures of 1-Hydroxyimidazole and Its Salts Crystals 2(4) (2012) 1492-1501
Space group: C 1 c 1
Cell volume: 568.26
Cell parameters: 3.6216; 17.385; 9.0259; 90; 90.499; 90;  

COD ID: 1508879
CIF file Formula: - C62 H70 F12 N7 O14 P2 -
Comments: Yan, Xuzhou; Li, Zhengtao; Wei, Peifa; Huang, Feihe Chemically-Responsive Complexation of A Diquaternary Salt with Bis(m-phenylene)-32-Crown-10 Derivatives and Host Substituent Effect on Complexation Geometry. Organic letters 15(3) (2013) 534-537
Space group: C 1 c 1
Cell volume: 6635
Cell parameters: 11.021; 22.8264; 26.376; 90; 90.593; 90;  

COD ID: 1508881
CIF file Formula: - C68 H82 F12 N4 O20 P2 -
Comments: Yan, Xuzhou; Li, Zhengtao; Wei, Peifa; Huang, Feihe Chemically-Responsive Complexation of A Diquaternary Salt with Bis(m-phenylene)-32-Crown-10 Derivatives and Host Substituent Effect on Complexation Geometry. Organic letters 15(3) (2013) 534-537
Space group: C 1 c 1
Cell volume: 7887.5
Cell parameters: 17.9964; 13.7356; 32.6891; 90; 102.548; 90;  

COD ID: 1509349
CIF file Formula: - Ag Ga S2 -
Comments: Ishizawa, N.; Kitahara Eba, H.; Noda, Y.; Marumo, F. Synchrotron X-ray stuy of the monoclinic high-pressure structure of Ag Ga S2 Physical Review, Serie 3. B - Condensed Matter (18,1978-) 61 (2000) 3310-3316
Space group: C 1 c 1
Cell volume: 313.693
Cell parameters: 8.031; 8.014; 6.221; 90; 128.42; 90;  

COD ID: 1509712
CIF file Formula: - Ag2 S3 Te -
Comments: Pertlik, F. Crystal structure of Ag2 Te S3 and Na (Na1-x Agx) Te S3 (x = 0.5) and the geometry of Te(IV) S3 polyhedra Monatshefte fuer Chemie und verwandte Teile anderer Wissenschaften (109,1978-) 128 (1997) 157-163
Space group: C 1 c 1
Cell volume: 549.501
Cell parameters: 6.783; 11.567; 7.693; 90; 114.44; 90;  

COD ID: 1509808
CIF file Formula: - Ag2 Ge In2 Se6 -
Comments: Glowyak, T.; Sysa, L.V.; Krykhovets, O.V.; Olekseyuk, I.D. Crystal structure of Ag2 In2 Ge Se6 Journal of Alloys Compd. 287 (1999) 181-184
Space group: C 1 c 1
Cell volume: 1133.34
Cell parameters: 12.692; 7.492; 12.644; 90; 109.5; 90;  

COD ID: 1509870
CIF file Formula: - Ag4 Cd Ge2 S7 -
Comments: Parasyuk, O.V.; Olekseyuk, I.D.; Gulay, L.D. Crystal structures of the Ag4 Hg Ge2 S7 and Ag4 Cd Ge2 S7 compounds Journal of Alloys Compd. 340 (2002) 157-166
Space group: C 1 c 1
Cell volume: 1252.78
Cell parameters: 17.4364; 6.8334; 10.535; 90; 93.589; 90;  

COD ID: 1509873
CIF file Formula: - Ag4 Ge2 Hg S7 -
Comments: Olekseyuk, I.D.; Gulay, L.D.; Parasyuk, O.V. Crystal structures of the Ag4 Hg Ge2 S7 and Ag4 Cd Ge2 S7 compounds Journal of Alloys Compd. 340 (2002) 157-166
Space group: C 1 c 1
Cell volume: 1249.83
Cell parameters: 17.4546; 6.8093; 10.5342; 90; 93.398; 90;  

COD ID: 1510637
CIF file Formula: - B2 Ba S4 -
Comments: Wulff, M.; Krebs, B.; Hammerschmidt, A.; Doech, M. Ba B2 S4 : das erste nicht-oxidische Chalkogenoborat mit trigonal-planar und tetraedrisch koordiniertem Bor Zeitschrift fuer Anorganische und Allgemeine Chemie 628 (2002) 2637-2640
Space group: C 1 c 1
Cell volume: 587.631
Cell parameters: 6.6465; 15.6995; 6.0306; 90; 110.961; 90;  

COD ID: 1510870
CIF file Formula: - B3 Ba Li S6 -
Comments: Krebs, B.; Hiltmann, F. Li Ba B S3 und Li Ba B3 S6: zwei neue quaternaere thioborate mit trigonal-planar koordiniertem Bor Zeitschrift fuer Anorganische und Allgemeine Chemie 621 (1995) 424-430
Space group: C 1 c 1
Cell volume: 968.031
Cell parameters: 15.116; 8.824; 8.179; 90; 117.46; 90;  

COD ID: 1510927
CIF file Formula: - B3 Li S6 Sr -
Comments: Diercks, H.; Puettmann, C.; Krebs, B. Synthesis, crystal structures and properties of M3 B3 S6 (M= Na, K, Rb) and Li Sr B3 S6 Phosphorus, Sulfur, Silicon and Related Elements 65 (1992) 1-4
Space group: C 1 c 1
Cell volume: 912.794
Cell parameters: 14.933; 8.703; 7.866; 90; 116.76; 90;  

COD ID: 1511522
CIF file Formula: - B4.68 Mn Na2 O11 Zn2 -
Comments: Malinovskii, Yu.A.; Bondareva, O.S.; Belov, N.V. The crystal structure of Na2 Zn2 Mn B4.67 O11 Kristallografiya 25 (1980) 944-949
Space group: C 1 c 1
Cell volume: 835.621
Cell parameters: 4.972; 8.613; 19.513; 90; 90.02; 90;  

COD ID: 1511755
CIF file Formula: - B4 La O12 Sc3 -
Comments: Wang, G.-F.; Lu, S.-F.; Chen, W.-Z.; Wu, Q.-J.; He, M.-Y.; Lin, Z.-B. Structure of low temperature phase gamma-(La Sc3 (B O3)4) crystal Materials Research Innovation 2 (1999) 341-344
Space group: C 1 c 1
Cell volume: 887.789
Cell parameters: 7.74; 9.864; 12.066; 90; 105.48; 90;  

COD ID: 1511907
CIF file Formula: - C16 H22 Br N O5 S -
Comments: Nocquet-Thibault, Sophie; Retailleau, Pascal; Cariou, Kevin; Dodd, Robert H. Iodine(III)-Mediated Umpolung of Bromide Salts for the Ethoxybromination of Enamides. Organic letters 15(8) (2013) 1842-1845
Space group: C 1 c 1
Cell volume: 1915.1
Cell parameters: 8.334; 17.631; 13.162; 90; 98.01; 90;  

COD ID: 1512083
CIF file Formula: - C48 H60 F12 N4 O4 Pd Sb2 -
Comments: Kuriyama, Masami; Matsuo, Seira; Shinozawa, Mina; Onomura, Osamu Ether-imidazolium carbenes for suzuki-miyaura cross-coupling of heteroaryl chlorides with aryl/heteroarylboron reagents. Organic letters 15(11) (2013) 2716-2719
Space group: C 1 c 1
Cell volume: 5344.9
Cell parameters: 11.9986; 23.347; 19.104; 90; 92.8783; 90;  

COD ID: 1512138
CIF file Formula: - C30 H18 Br4 F12 N6 P2 Ru -
Comments: Vallett, Paul J.; Damrauer, Niels H. Experimental and computational exploration of ground and excited state properties of highly strained ruthenium terpyridine complexes. The journal of physical chemistry. A 117(30) (2013) 6489-6507
Space group: C 1 c 1
Cell volume: 8372
Cell parameters: 20.5937; 18.9018; 22.083; 90; 103.108; 90;  

COD ID: 1512203
CIF file Formula: - C13 H11 F I N O3 -
Comments: Pretali, Luca; Dondi, Daniele; D'Angelantonio, Mila; Manet, Ilse; Fasani, Elisa; Monti, Sandra; Bovio, Bruna; Albini, Angelo A Fluorine 1,2-Migration via Aryl Cation/Radical/Radical Anion/Radical Sequence. Organic letters 15(15) (2013) 3926-3929
Space group: C 1 c 1
Cell volume: 1301.8
Cell parameters: 12.798; 14.387; 7.154; 90; 98.78; 90;  

COD ID: 1512370
CIF file Formula: - C19 H19 N O -
Comments: Race, Nicholas J.; Bower, John F. Palladium catalyzed cyclizations of oxime esters with 1,2-disubstituted alkenes: synthesis of dihydropyrroles. Organic letters 15(17) (2013) 4616-4619
Space group: C 1 c 1
Cell volume: 1483.51
Cell parameters: 31.489; 7.4022; 6.4814; 90; 100.894; 90;  

COD ID: 1512884
CIF file Formula: - C27 H36 Cl N2 O P Pt -
Comments: Daniela Belli Dell Amico; Claudio Broglia; Luca Labella; Fabio Marchetti; Daniele Mendola; Simona Samaritani Platinum(II) complexes containing unsaturated ligands. Nucleophilic substitution versus nucleophilic attack to ligand: a stereochemistry driven outcome Inorganica Chimica Acta 395 (2013) 181-188
Space group: C 1 c 1
Cell volume: 2800.55
Cell parameters: 16.6781; 12.3373; 14.9107; 90; 114.104; 90;  

COD ID: 1512889
CIF file Formula: - C42 H38 Cl6 Co F6 N4 O4 P -
Comments: Hasti Iranmanesh; Mahdi Behzad; Giuseppe Bruno; Hadi Amiri Rudbari; Hossein Nazari; Abolfazl Mohammadi; Omid Taheri Cobalt(III) Schiff base complexes derived from mesostilbenediamine: Synthesis, characterization, crystal structure, electrochemistry and antibacterial studies Inorganica Chimica Acta 395 (2013) 81-88
Space group: C 1 c 1
Cell volume: 4702.22
Cell parameters: 11.5134; 17.7255; 23.1828; 90; 96.341; 90;  

COD ID: 1513001
CIF file Formula: - C36 H40 Cl8 Ni4 O16 -
Comments: Shu-Hua Zhang; Yi Dong Zhang; Hua Hong Zou; Jing Jing Guo; He Ping Li; You Song; Hong Liang A family of cubane cobalt and nickel clusters: Syntheses, structures and magnetic properties Inorganica Chimica Acta 396 (2013) 119-125
Space group: C 1 c 1
Cell volume: 4869.9
Cell parameters: 9.6063; 44.885; 11.7452; 90; 105.927; 90;  

COD ID: 1513011
CIF file Formula: - C31 H23 Cl N O3 V -
Comments: Dmitry A. Kurmaev; Nicolai A. Kolosov; Svetlana Ch. Gagieva; Alexandra O. Borissova; Vladislav A. Tuskaev; Natalya M. Bravaya; Boris M. Bulychev Coordination compounds of chromium (+3) and vanadium (+3) and (+5) with 2,6-bis(diphenylhydroxymethyl)pyridyl ligand: Synthesis and study of catalytic activity in the polymerization of ethylene Inorganica Chimica Acta 396 (2013) 136-143
Space group: C 1 c 1
Cell volume: 2515.9
Cell parameters: 10.5834; 15.1756; 16.0379; 90; 102.386; 90;  

COD ID: 1513081
CIF file Formula: - C12 H26 Cl Na O10 -
Comments: Mandai, Toshihiko; Nozawa, Risa; Tsuzuki, Seiji; Yoshida, Kazuki; Ueno, Kazuhide; Dokko, Kaoru; Watanabe, Masayoshi Phase diagrams and solvate structures of binary mixtures of glymes and na salts. The journal of physical chemistry. B 117(48) (2013) 15072-15085
Space group: C 1 c 1
Cell volume: 5503.3
Cell parameters: 12.138; 30.924; 15.3413; 90; 107.119; 90;  

COD ID: 1513214
CIF file Formula: - C20 H26 B10 Cu2 N4 -
Comments: Vologzhanina, Anna V.; Korlyukov, Alexander A.; Avdeeva, Varvara V.; Polyakova, Irina N.; Malinina, Elena A.; Kuznetsov, Nikolai T. Theoretical QTAIM, ELI-D, and Hirshfeld Surface Analysis of the Cu-(H)B Interaction in [Cu2(bipy)2B10H10]. The journal of physical chemistry. A 117(49) (2013) 13138-13150
Space group: C 1 c 1
Cell volume: 2410.2
Cell parameters: 15.5479; 10.6631; 14.845; 90; 101.674; 90;  

COD ID: 1513260
CIF file Formula: - C24 H30 O2 -
Comments: Olive, Alexandre G. L.; Raffy, Guillaume; Allouchi, Hassan; Léger, Jean-Michel; Del Guerzo, André; Desvergne, Jean-Pierre Striking Correlation between the Unusual Trigonal Crystal Packing and the Ability to Self-Assemble into Nanofibers of 2,3-Di-n-alkyloxyanthracenes† Langmuir 25(15) (2009) 8606-8614
Space group: C 1 c 1
Cell volume: 4160.6
Cell parameters: 32.99; 14.4951; 8.8108; 90; 99.065; 90;  

COD ID: 1513405
CIF file Formula: - C5 H3 N11 O2 -
Comments: Palysaeva, Nadezhda V.; Kumpan, Katerina P.; Struchkova, Marina I.; Dalinger, Igor L.; Kormanov, Aleksandr V.; Aleksandrova, Nataly S.; Chernyshev, Victor M.; Pyreu, Dmitrii F.; Suponitsky, Kyrill Yu; Sheremetev, Aleksei B. A Direct Approach to a 6-Hetarylamino[1,2,4]triazolo[4,3-b][1,2,4,5]tetrazine Library. Organic letters 16(2) (2014) 406-409
Space group: C 1 c 1
Cell volume: 1852.7
Cell parameters: 19.461; 8.7866; 11.3296; 90; 106.997; 90;  

COD ID: 1513410
CIF file Formula: - C21 H17 N -
Comments: Narbonne, Vanessa; Retailleau, Pascal; Maestri, Giovanni; Malacria, Max Diastereoselective Synthesis of Dibenzoazepines through Chelation on Palladium(IV) Intermediates. Organic letters 16(2) (2014) 628-631
Space group: C 1 c 1
Cell volume: 1572.7
Cell parameters: 7.507; 27.831; 7.592; 90; 97.477; 90;  

COD ID: 1513616
CIF file Formula: - C88 H180 K4 Mg4 N8 -
Comments: Martínez-Martínez, A. J.; Armstrong, D. R.; Conway, B.; Fleming, B. J.; Klett, J.; Kennedy, A. R.; Mulvey, R. E.; Robertson, S. D.; O'Hara, C. T. Pre-inverse-crowns: synthetic, structural and reactivity studies of alkali metal magnesiates primed for inverse crown formation Chemical Science 5(2) (2014) 771
Space group: C 1 c 1
Cell volume: 10684
Cell parameters: 25.779; 25.754; 16.135; 90; 94.132; 90;  

COD ID: 1513646
CIF file Formula: - C21 H22 Cl Cu N4 O10 Re -
Comments: Easun, Timothy L.; Jia, Junhua; Reade, Thomas J.; Sun, Xue-Zhong; Davies, E. Stephen; Blake, Alexander J.; George, Michael W.; Champness, Neil R. Modification of coordination networks through a photoinduced charge transfer process Chemical Science 5(2) (2014) 539
Space group: C 1 c 1
Cell volume: 2604.5
Cell parameters: 10.0183; 27.574; 9.4686; 90; 95.291; 90;  

COD ID: 1513844
CIF file Formula: - C54 H72 As N4 P2 -
Comments: Tondreau, Aaron M.; Benkő, Zoltán; Harmer, Jeffrey R.; Grützmacher, Hansjörg Sodium phosphaethynolate, Na(OCP), as a “P” transfer reagent for the synthesis of N-heterocyclic carbene supported P3 and PAsP radicals Chemical Science 5(4) (2014) 1545
Space group: C 1 c 1
Cell volume: 10554
Cell parameters: 10.2682; 42.469; 24.23; 90; 92.756; 90;  

COD ID: 1514176
CIF file Formula: - C21 H22 O10 -
Comments: Li, Hanxiang; Jiang, Jieyi; Liu, Zhaoming; Lin, Shaoe; Xia, Guoping; Xia, Xuekui; Ding, Bo; He, Lei; Lu, Yongjun; She, Zhigang Peniphenones A-D from the Mangrove Fungus Penicillium dipodomyicola HN4-3A as Inhibitors of Mycobacterium tuberculosis Phosphatase MptpB. Journal of natural products 77(4) (2014) 800-806
Space group: C 1 c 1
Cell volume: 1937.4
Cell parameters: 4.3655; 49.452; 8.9782; 90; 91.731; 90;  

COD ID: 1514339
CIF file Formula: - C2.11 H2.39 N0.42 O0.7 -
Comments: Subhasri, Annamalai; Anbuselvan, Chinnadurai Facile, cost effective synthesis and DFT-based studies of substituted aryl hydrazones of β-diketones: a new selective fluorescent chemosensor for Co2+ Analytical Methods 6(15) (2014) 5596
Space group: C 1 c 1
Cell volume: 3035.7
Cell parameters: 23.38; 6.969; 19.937; 90; 110.851; 90;  

COD ID: 1514413
CIF file Formula: - C50 H70 Li2 N2 P2 Si4 -
Comments: Nako, Adi E.; White, Andrew J. P.; Crimmin, Mark R. A metal‒amide dependent, catalytic C‒H functionalisation of triphenylphosphonium methylide Chemical Science 4(2) (2013) 691
Space group: C 1 c 1
Cell volume: 10538
Cell parameters: 18.8666; 22.2888; 25.4992; 90; 100.652; 90;  

COD ID: 1514479
CIF file Formula: - C144 H130 B4 Co4 F40 N30 O24 S8 -
Comments: King, Amanda E.; Surendranath, Yogesh; Piro, Nicholas A.; Bigi, Julian P.; Long, Jeffrey R.; Chang, Christopher J. A mechanistic study of proton reduction catalyzed by a pentapyridine cobalt complex: evidence for involvement of an anation-based pathway Chemical Science 4(4) (2013) 1578
Space group: C 1 c 1
Cell volume: 7902.52
Cell parameters: 17.791; 16.341; 27.415; 90; 97.47; 90;  

COD ID: 1514786
CIF file Formula: - C23 H29 F12 N7 Ni P2 -
Comments: Williams, Valerie A.; Hulley, Elliott B.; Wolczanski, Peter T.; Lancaster, Kyle M.; Lobkovsky, Emil B. Exploring the limits of redox non-innocence: pseudo square planar [{κ4-Me2C(CH2NCHpy)2}Ni]n (n = 2+, 1+, 0, −1, −2) favor Ni(ii) Chemical Science 4(9) (2013) 3636
Space group: C 1 c 1
Cell volume: 3181.2
Cell parameters: 9.223; 23.7522; 15.2139; 90; 107.35; 90;  

COD ID: 1514817
CIF file Formula: - C18 H12 O2 -
Comments: Cheng, Ming; Yan, Jianwei; Hu, Feng; Chen, Hong; Hu, Youhong Palladium-catalyzed cascade reactions of 3-iodochromones with aryl iodides and norbornadiene leading to annulated xanthones Chemical Science 4(1) (2013) 526
Space group: C 1 c 1
Cell volume: 10031
Cell parameters: 20.7703; 20.6316; 23.952; 90; 102.233; 90;  

COD ID: 1514881
CIF file Formula: - C10 H14 O2 -
Comments: Unold, Jörg; Wang, Dongren; Frey, Wolfgang; Buchmeiser, Michael R. Stereo- and regioselective cyclopolymerization of chiral 1,7-octadiynes Polymer Chemistry 4(15) (2013) 4219
Space group: C 1 c 1
Cell volume: 1831.4
Cell parameters: 14.8047; 24.843; 5.0851; 90; 101.707; 90;  

COD ID: 1514951
CIF file Formula: - C28 H42 F6 N O6 P -
Comments: Dasgupta, Suvankar; Wu, Jishan Formation of [2]rotaxanes by encircling [20], [21] and [22]crown ethers onto the dibenzylammonium dumbbell Chemical Science 3(2) (2012) 425
Space group: C 1 c 1
Cell volume: 3092.8
Cell parameters: 13.4798; 24.491; 11.104; 90; 122.469; 90;  

COD ID: 1515026
CIF file Formula: - C57 H60 F6 Hg N6 O P Sb -
Comments: Lin, Tzu-Pin; Nelson, Ryan C.; Wu, Tianpin; Miller, Jeffrey T.; Gabbaï, François P. Lewis acid enhancement by juxtaposition with an onium ion: the case of a mercury stibonium complex Chemical Science 3(4) (2012) 1128
Space group: C 1 c 1
Cell volume: 5341
Cell parameters: 18.171; 28.753; 13.422; 90; 130.397; 90;  

COD ID: 1515073
CIF file Formula: - C22 H25 N3 O7 -
Comments: Meng, Wei; Zhao, Hai-Tao; Nie, Jing; Zheng, Yan; Fu, Aiping; Ma, Jun-An Allenoate-derived 1,5-, 1,7-, and 1,9-zwitterions as highly versatile coupling-partners for phosphine-triggered cycloaddition reactions Chemical Science 3(10) (2012) 3053
Space group: C 1 c 1
Cell volume: 2180.5
Cell parameters: 15.778; 16.681; 8.324; 90; 95.55; 90;  

COD ID: 1515153
CIF file Formula: - C20 H10 Br2 O5 -
Comments: Fallon, Thomas; Willis, Anthony C.; Rae, A. David; Paddon-Row, Michael N.; Sherburn, Michael S. β-Oligofurans Chemical Science 3(6) (2012) 2133
Space group: C 1 c 1
Cell volume: 1762
Cell parameters: 8.1262; 15.991; 13.825; 90; 101.243; 90;  

COD ID: 1515283
CIF file Formula: - B H8 Li N2 -
Comments: He, Teng; Wu, Hui; Wu, Guotao; Wang, Junhu; Zhou, Wei; Xiong, Zhitao; Chen, Juner; Zhang, Tao; Chen, Ping Borohydride hydrazinates: high hydrogen content materials for hydrogen storage Energy & Environmental Science 5(2) (2012) 5686
Space group: C 1 c 1
Cell volume: 821.08
Cell parameters: 12.1653; 6.7288; 10.3724; 90; 104.751; 90;  

COD ID: 1515509
CIF file Formula: - C66 H64 F24 N10 O4 P4 -
Comments: Serpell, Christopher J.; Cookson, James; Thompson, Amber L.; Beer, Paul D. A dual-functional tetrakis-imidazolium macrocycle for supramolecular assembly Chemical Science 2(3) (2011) 494
Space group: C 1 c 1
Cell volume: 6830.59
Cell parameters: 17.5254; 12.7345; 30.6082; 90; 90.6673; 90;  

COD ID: 1515571
CIF file Formula: - C16 H12 Br2 N2 -
Comments: Vecchione, Matthew K.; Sun, Aaron X.; Seidel, Daniel Divergent reactions of indoles with aminobenzaldehydes: indole ring-opening vs. annulation and facile synthesis of neocryptolepine Chemical Science 2(11) (2011) 2178
Space group: C 1 c 1
Cell volume: 1423.6
Cell parameters: 11.3993; 20.292; 6.8679; 90; 116.348; 90;  

COD ID: 1515732
CIF file Formula: - C24 H24 O -
Comments: Kuzmanich, Gregory; Natarajan, Arunkumar; Shi, Yanhui; Patrick, Brian O.; Scheffer, John R.; Garcia-Garibay, Miguel A Stable radicals during photodecarbonylations of trityl-alkyl ketones enable solid state reactions through primary and secondary radical centers. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 10(11) (2011) 1731-1734
Space group: C 1 c 1
Cell volume: 1864.2
Cell parameters: 16.034; 8.5909; 15.611; 90; 119.895; 90;  

COD ID: 1515735
CIF file Formula: - C21 H20 N2 O -
Comments: Shiraki, Saori; Natarajan, Arunkumar; Garcia-Garibay, Miguel A The synthesis and stereospecific solid-state photodecarbonylation of hexasubstituted meso- and d,l-ketones. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 10(9) (2011) 1480-1487
Space group: C 1 c 1
Cell volume: 1770.6
Cell parameters: 7.3178; 14.158; 17.191; 90; 96.227; 90;  

COD ID: 1515736
CIF file Formula: - C17 H25 N O -
Comments: Ayitou, Anoklase Jean-Luc; Vallavoju, Nandini; Ugrinov, Angel; Sivaguru, J. Enantiospecific 6π-photocyclization of atropisomeric α-substituted acrylanilides in the solid-state: role of crystalline confinement on enantiospecificity. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 10(9) (2011) 1380-1383
Space group: C 1 c 1
Cell volume: 1615.8
Cell parameters: 8.7219; 14.862; 12.6513; 90; 99.836; 90;  

COD ID: 1515747
CIF file Formula: - C21 H24 N5 Ni O14 Sm -
Comments: Xiao, Guoqi; Yan, Bing; Ma, Rui; Jin, Wen Juan; Lü, Xing Qiang; Ding, Li Qin; Zeng, Chu; Chen, Lei Lei; Bao, Feng Bulk ring-opening polymerization (ROP) of L-lactide catalyzed by Ni(ii) and Ni(ii)-Sm(iii) complexes based on a salen-type schiff-base ligand Polymer Chemistry 2(3) (2011) 659
Space group: C 1 c 1
Cell volume: 2759.9
Cell parameters: 11.276; 26.738; 9.1772; 90; 94.07; 90;  

COD ID: 1515859
CIF file Formula: - C66 H50 O4 -
Comments: Karim, Arif R.; Linden, Anthony; Baldridge, Kim K.; Siegel, Jay S. Symmetry and polar-π effects on the dynamics of enshrouded aryl-alkyne molecular rotors Chemical Science 1(1) (2010) 102
Space group: C 1 c 1
Cell volume: 4990.2
Cell parameters: 35.6175; 9.396; 14.925; 90; 92.4734; 90;  

COD ID: 1515866
CIF file Formula: - C73 H86 N2 O18 U -
Comments: Beer, Stephan; Berryman, Orion B.; Ajami, Dariush; Rebek Jr., Julius Encapsulation of the uranyl dication Chemical Science 1(1) (2010) 43
Space group: C 1 c 1
Cell volume: 7007
Cell parameters: 18.534; 19.636; 19.425; 90; 97.62; 90;  

COD ID: 1516097
CIF file Formula: - C11 H12 O5 -
Comments: Barradas, Silvia; Hernández-Torres, Gloria; Urbano, Antonio; Carreño, M Carmen Total synthesis of natural p-quinol cochinchinenone. Organic letters 14(23) (2012) 5952-5955
Space group: C 1 c 1
Cell volume: 1025.92
Cell parameters: 10.4253; 12.8651; 8.1381; 90; 109.962; 90;  

COD ID: 1516451
CIF file Formula: - C42 H58 N2 O2 Si2 -
Comments: Salata, Michael R.; Marks, Tobin J. Catalyst Nuclearity Effects in Olefin Polymerization. Enhanced Activity and Comonomer Enchainment in Ethylene + Olefin Copolymerizations Mediated by Bimetallic Group 4 Phenoxyiminato Catalysts Macromolecules 42(6) (2009) 1920
Space group: C 1 c 1
Cell volume: 4040.1
Cell parameters: 26.914; 9.765; 16.289; 90; 109.311; 90;  

COD ID: 1516779
CIF file Formula: - C15 H14 O2 S -
Comments: Liu, Feng-Lei; Chen, Jia-Rong; Zou, You-Quan; Wei, Qiang; Xiao, Wen-Jing Three-Component Coupling Reaction Triggered by Insertion of Arynes into the S═O Bond of DMSO. Organic letters 16(14) (2014) 3768
Space group: C 1 c 1
Cell volume: 2612.8
Cell parameters: 14.341; 11.316; 17.625; 90; 114.01; 90;  

COD ID: 1517029
CIF file Formula: - C30 H47 N Ni O P2 -
Comments: Yoo, Changho; Oh, Seohee; Kim, Jin; Lee, Yunho Transmethylation of a four-coordinate nickel(i) monocarbonyl species with methyl iodide Chemical Science 5(10) (2014) 3853
Space group: C 1 c 1
Cell volume: 3053.92
Cell parameters: 16.6022; 12.4707; 16.0966; 90; 113.6; 90;  

COD ID: 1517168
CIF file Formula: - C5 Cl3 Fe Ga O5 -
Comments: Braunschweig, Holger; Dewhurst, Rian D.; Hupp, Florian; Kaufmann, Christina; Phukan, Ashwini K.; Schneider, Christoph; Ye, Qing Gauging metal Lewis basicity of zerovalent iron complexes via metal-only Lewis pairs Chemical Science 5(10) (2014) 4099
Space group: C 1 c 1
Cell volume: 1128.9
Cell parameters: 9.0504; 10.731; 11.634; 90; 92.431; 90;  

COD ID: 1517181
CIF file Formula: - C24 H30 N8 O6 -
Comments: Wang, Qi-Qiang; Day, Victor W.; Bowman-James, Kristin Macrocyclic Influences in CO2 Uptake and Stabilization. Organic letters 16(15) (2014) 3982-3985
Space group: C 1 c 1
Cell volume: 2388.9
Cell parameters: 9.5929; 13.2942; 18.7485; 90; 92.399; 90;  

COD ID: 1517190
CIF file Formula: - C145 H234 N48 Ni16 O96 S8 -
Comments: Pang, Jiandong; Jiang, Feilong; Yuan, Daqiang; Zheng, Jun; Wu, Mingyan; Liu, Guoliang; Su, Kongzhao; Hong, Maochun SO42−anion directed hexagonal-prismatic cages via cooperative C‒H⋯O hydrogen bonds Chem. Sci. 5(11) (2014) 4163
Space group: C 1 c 1
Cell volume: 21060.1
Cell parameters: 44.0087; 20.5888; 26.8381; 90; 119.998; 90;  

COD ID: 1517249
CIF file Formula: - C15 H22 O5 -
Comments: Kasare, Sanghratna; Bankar, Siddheshwar K.; Ramasastry, S. S. V. Expeditious Metal-Free Access to Functionalized Polycyclic Acetals under Mild Aqueous Conditions. Organic letters 16(16) (2014) 4284-4287
Space group: C 1 c 1
Cell volume: 1479.6
Cell parameters: 10.478; 15.304; 9.535; 90; 104.6; 90;  

COD ID: 1517446
CIF file Formula: - C110 H160 Dy2 K N8 O13 -
Comments: Demir, Selvan; Nippe, Michael; Gonzalez, Miguel I.; Long, Jeffrey R. Exchange coupling and magnetic blocking in dilanthanide complexes bridged by the multi-electron redox-active ligand 2,3,5,6-tetra(2-pyridyl)pyrazine Chem. Sci. 5(12) (2014) 4701
Space group: C 1 c 1
Cell volume: 10789
Cell parameters: 22.168; 25.23; 20.706; 90; 111.311; 90;  

COD ID: 1517850
CIF file Formula: - C36 H30 Cl3 N O P2 V -
Comments: Rubenstahl, Thilo; Dehnicke, Kurt; Krautscheid, Harald [VCl3(NPPh3)(OPPh3)], ein phosphaniminato-komplex von vanadium(IV)' Zeitschrift fuer Anorganische und Allgemeine Chemie 619 (1993) 1023-1026
Space group: C 1 c 1
Cell volume: 3449
Cell parameters: 10.18; 18.26; 18.59; 90; 93.65; 90;  

COD ID: 1517901
CIF file Formula: - C27 H21 N O2 -
Comments: Zhang, Xuan; Si, Weili; Bao, Ming; Asao, Naoki; Yamamoto, Yoshinori; Jin, Tienan Rh(III)-Catalyzed Regioselective Functionalization of C-H Bonds of Naphthylcarbamates for Oxidative Annulation with Alkynes. Organic letters 16(18) (2014) 4830-4833
Space group: C 1 c 1
Cell volume: 4073.6
Cell parameters: 12.5831; 38.828; 10.3741; 90; 126.514; 90;  

COD ID: 1518134
CIF file Formula: - C28 H27 Cl N2 S -
Comments: Ranjan, Alok; Yerande, Ragini; Wakchaure, Prasad B.; Yerande, Swapnil G.; Dethe, Dattatraya H. Base-Mediated Hydroamination of Propargylamine: A Regioselective Intramolecular 5-exo-dig Cycloisomerization en Route to Imidazole-2-thione. Organic letters 16(21) (2014) 5788-5791
Space group: C 1 c 1
Cell volume: 2402.7
Cell parameters: 21.221; 9.6494; 12.1702; 90; 105.393; 90;  

COD ID: 1518201
CIF file Formula: - C12 H34 Cl2 Li2 O11 -
Comments: Chang, Tsing-Lien; Zhao, Ming; Hu, Ning-Hai; Jin, Zhong-Sheng The crystal structure of 18-crown-6 complexes of hydrated lithium chloride and bromide Revue de Chimie Minerale 24 (1987) 382-390
Space group: C 1 c 1
Cell volume: 2191.8
Cell parameters: 17.835; 9.634; 16.025; 90; 127.25; 90;  

COD ID: 1518202
CIF file Formula: - C12 H34 Br2 Li2 O11 -
Comments: Chang, Tsing-Lien; Zhao, Ming; Hu, Ning-Hai; Jin, Zhong-Sheng The crystal structure of 18-crown-6 complexes of hydrated lithium chloride and bromide Revue de Chimie Minerale 24 (1987) 382-390
Space group: C 1 c 1
Cell volume: 2284
Cell parameters: 18.121; 9.745; 16.14; 90; 126.74; 90;  

COD ID: 1518355
CIF file Formula: - C32 H44 K N2 O13 Rh -
Comments: Murphy, Stephen K.; Bruch, Achim; Dong, Vy M. Mechanistic insights into hydroacylation with non-chelating aldehydes Chemical Science 6(1) (2015) 174-180
Space group: C 1 c 1
Cell volume: 3686.2
Cell parameters: 13.6052; 19.6523; 14.3113; 90; 105.559; 90;  

COD ID: 1518450
CIF file Formula: - C28 H46 N4 O19 Tm -
Comments: Funk, Alexander M.; Finney, Katie-Louise N. A.; Harvey, Peter; Kenwright, Alan M.; Neil, Emily R.; Rogers, Nicola J.; Kanthi Senanayake, P.; Parker, David Critical analysis of the limitations of Bleaney's theory of magnetic anisotropy in paramagnetic lanthanide coordination complexes Chem. Sci. 6(3) (2015) 1655
Space group: C 1 c 1
Cell volume: 3317.3
Cell parameters: 23.1686; 9.677; 16.8001; 90; 118.272; 90;  

COD ID: 1518487
CIF file Formula: - C24 H24 O6 -
Comments: Zhang, Junhui; Xing, Siyang; Ren, Jun; Jiang, Shende; Wang, Zhongwen Lewis Acid catalyzed intramolecular [3 + 2] cross cycloadditions of cobalt-alkynylcyclopropane 1,1-diesters with carbonyls for construction of medium-sized and polycyclic skeletons. Organic letters 17(2) (2015) 218-221
Space group: C 1 c 1
Cell volume: 1960
Cell parameters: 17.142; 9.0363; 12.653; 90; 90.03; 90;  

COD ID: 1518586
CIF file Formula: - C60.5 H56 N4 O6 -
Comments: Liu, Lei; Carroll, Patrick J.; Kozlowski, Marisa C. Vanadium-catalyzed regioselective oxidative coupling of 2-hydroxycarbazoles. Organic letters 17(3) (2015) 508-511
Space group: C 1 c 1
Cell volume: 9642.7
Cell parameters: 16.1723; 24.7158; 24.1251; 90; 90.474; 90;  

COD ID: 1518727
CIF file Formula: - C53 H53 F3 N4 O3 P2 S -
Comments: Roth, Torsten; Vasilenko, Vladislav; Benson, Callum G. M.; Wadepohl, Hubert; Wright, Dominic S.; Gade, Lutz H. Extending N-heterocyclic carbene ligands into the third dimension: a new type of hybrid phosphazane/NHC system Chem. Sci. 6(4) (2015) 2506
Space group: C 1 c 1
Cell volume: 4923.42
Cell parameters: 24.05898; 12.60445; 17.26646; 90; 109.899; 90;  

COD ID: 1518902
CIF file Formula: - C23 H25 O P -
Comments: Fliedel, Christophe; Rosa, Vitor; Alves, Filipa M.; Martins, Ana M.; Avilés, Teresa; Dagorne, Samuel P,O-Phosphinophenolate zinc(ii) species: synthesis, structure and use in the ring-opening polymerization (ROP) of lactide, ε-caprolactone and trimethylene carbonate. Dalton transactions (Cambridge, England : 2003) 44(27) (2015) 12376-12387
Space group: C 1 c 1
Cell volume: 1951.8
Cell parameters: 13.3231; 13.0236; 11.3086; 90; 95.911; 90;  

COD ID: 1519058
CIF file Formula: - C2 H5 O6 P2 Sb -
Comments: Brian A. Adair; Graciela Diaz de Delgado; J. Miguel Delgado; Anthony K. Cheetham On the synthesis and characterization of open-framework antimony(III) diphosphonates Solid State Sciences 2 (2000) 119-126
Space group: C 1 c 1
Cell volume: 1318.54
Cell parameters: 4.6707; 16.9992; 16.7699; 90; 98; 90;  

COD ID: 1519244
CIF file Formula: - C21 H24 Br N O -
Comments: Pelter, Andy; Coles, Simon J.; Hursthouse, Michael B. C21H24BrNO Crystal Structure Report Archive (2000) 777
Space group: C 1 c 1
Cell volume: 1824.8
Cell parameters: 14.845; 15; 9.045; 90; 115.04; 90;  

COD ID: 1519312
CIF file Formula: - C21 H21 N O3 -
Comments: Gelbrich, Thomas; Le Strat, Frederic; Harrowven, David C; Hursthouse, Michael B. 5-(4,4-Diethoxybut-2-yn-1-yl)phenanthridin-6(5H)-one Crystal Structure Report Archive (2001) 400
Space group: C 1 c 1
Cell volume: 1690.2
Cell parameters: 25.85; 4.6425; 16.978; 90; 123.95; 90;  

COD ID: 1519336
CIF file Formula: - C21 H25 N O2 -
Comments: Pelter, Andy; Coles, Simon J.; Hursthouse, Michael B. C21H25NO2 Crystal Structure Report Archive (2001) 779
Space group: C 1 c 1
Cell volume: 3462.6
Cell parameters: 7.7318; 27.917; 16.43; 90; 102.48; 90;  

COD ID: 1519342
CIF file Formula: - C26 H31 N3 O2 -
Comments: Coles, Simon J.; Chapman, C. P.; Light, Mark E.; Tizzard, G. J.; Camiolo, S.; Gale, Phil A.; Hursthouse, Michael B. N,N'-Di-n-butyl-3,4-diphenyl-1H-pyrrole-2,5-dicarboxamide Crystal Structure Report Archive (2001) 114
Space group: C 1 c 1
Cell volume: 4581.75
Cell parameters: 25.5294; 18.9718; 9.713; 90; 103.111; 90;  

COD ID: 1519385
CIF file Formula: - C39 H65 Cl3 Fe Mo N P2 -
Comments: Kuriyama, Shogo; Arashiba, Kazuya; Nakajima, Kazunari; Tanaka, Hiromasa; Yoshizawa, Kazunari; Nishibayashi, Yoshiaki Nitrogen fixation catalyzed by ferrocene-substituted dinitrogen-bridged dimolybdenum‒dinitrogen complexes: unique behavior of ferrocene moiety as redox active site Chem. Sci. 6(7) (2015) 3940
Space group: C 1 c 1
Cell volume: 4144.4
Cell parameters: 21.9221; 15.852; 14.007; 90; 121.631; 90;  

COD ID: 1519387
CIF file Formula: - C40 H57 Cl5 Fe Mo N P2 -
Comments: Kuriyama, Shogo; Arashiba, Kazuya; Nakajima, Kazunari; Tanaka, Hiromasa; Yoshizawa, Kazunari; Nishibayashi, Yoshiaki Nitrogen fixation catalyzed by ferrocene-substituted dinitrogen-bridged dimolybdenum‒dinitrogen complexes: unique behavior of ferrocene moiety as redox active site Chem. Sci. 6(7) (2015) 3940
Space group: C 1 c 1
Cell volume: 4379
Cell parameters: 18.9384; 19.521; 13.7984; 90; 120.86; 90;  

COD ID: 1519450
CIF file Formula: - C93 H80 N4 O24 S2 -
Comments: Ganesan, Paramaguru; Fu, Kunwu; Gao, Peng; Raabe, Ines; Schenk, Kurt; Scopelliti, Rosario; Luo, Jingshan; Wong, Lydia H.; Grätzel, Michael; Nazeeruddin, Mohammad Khaja A simple spiro-type hole transporting material for efficient perovskite solar cells Energy Environ. Sci. 8(7) (2015) 1986
Space group: C 1 c 1
Cell volume: 9908
Cell parameters: 43.879; 9.5887; 25.05; 90; 109.94; 90;  

COD ID: 1519505
CIF file Formula: - C17 H10 Br2 O2 S5 -
Comments: Bricklebank, Neil; Coles, Simon J.; Hursthouse, Michael B. C17H10Br2O2S5 Crystal Structure Report Archive (2002) 897
Space group: C 1 c 1
Cell volume: 3916.2
Cell parameters: 20.9579; 13.8067; 15.1219; 90; 116.493; 90;  

COD ID: 1519623
CIF file Formula: - C15 H10 I N O2 -
Comments: Huang, Hai; Zhu, Xiaolin; He, Guangke; Liu, Qi; Fan, Junzhen; Zhu, Hongjun Controlled Synthesis of 1,3,5-Oxadiazin-2-ones and Oxazolones through Regioselective Iodocyclization of Ynamides. Organic letters 17(10) (2015) 2510-2513
Space group: C 1 c 1
Cell volume: 1396.2
Cell parameters: 24.877; 7.087; 7.92; 90; 90.593; 90;  

COD ID: 1519655
CIF file Formula: - C20 H16 Br N O4 -
Comments: Lin, Chao; Zhen, Le; Cheng, Yong; Du, Hong-Jin; Zhao, Hui; Wen, Xiaoan; Kong, Ling-Yi; Xu, Qing-Long; Sun, Hongbin Visible-light induced isoindoles formation to trigger intermolecular diels-alder reactions in the presence of air. Organic letters 17(11) (2015) 2684-2687
Space group: C 1 c 1
Cell volume: 1719.4
Cell parameters: 14.0307; 8.5721; 15.203; 90; 109.89; 90;  

COD ID: 1519863
CIF file Formula: - C12 H12 Cl8 N8 O P6 -
Comments: Besli, S.; Kilic, A.; Davies, David B.; Coles, Simon J.; Hursthouse, Michael B. C12H12Cl8N8OP6 Crystal Structure Report Archive (2007) 303
Space group: C 1 c 1
Cell volume: 2817.98
Cell parameters: 14.6358; 16.3497; 12.3448; 90; 107.455; 90;  

COD ID: 1519879
CIF file Formula: - C10 H13 N O -
Comments: Coles, Susanne L.; Threlfall, Terry L.; Hursthouse, Michael B. N-(4-ethylphenyl)acetamide Crystal Structure Report Archive (2008) 1398
Space group: C 1 c 1
Cell volume: 925.2
Cell parameters: 4.5852; 21.3953; 9.431; 90; 90.001; 90;  

COD ID: 1519889
CIF file Formula: - C11 H13 N O3 -
Comments: Coles, Susanne L.; Threlfall, Terry L.; Hursthouse, Michael B. Ethyl 4-acetamidobenzoate Crystal Structure Report Archive (2008) 1396
Space group: C 1 c 1
Cell volume: 1060.14
Cell parameters: 8.4447; 19.281; 7.3108; 90; 117.051; 90;  

COD ID: 1519960
CIF file Formula: - C12 H23 N O4 -
Comments: Callear, Samantha K.; Hursthouse, Michael B. Hexamethyleneiminium adipate Crystal Structure Report Archive (2008) 556
Space group: C 1 c 1
Cell volume: 1336.3
Cell parameters: 13.8261; 11.0607; 9.6798; 90; 115.478; 90;  

COD ID: 1519989
CIF file Formula: - C4 H8 Cl4 N3 O2 P3 -
Comments: Coles, Simon J.; Hursthouse, Michael B.; Davies, David B.; Kilic, A.; Uslu, A. C4H8Cl4N3O2P3 Crystal Structure Report Archive (2008) 484
Space group: C 1 c 1
Cell volume: 1312.56
Cell parameters: 14.8296; 6.0926; 15.4113; 90; 109.5; 90;  

COD ID: 1520163
CIF file Formula: - C8 H14 N2 O5 -
Comments: Callear, Samantha K.; Hursthouse, Michael B. Glutaric acid 2-imidazolidinone Crystal Structure Report Archive (2008) 501
Space group: C 1 c 1
Cell volume: 1032.43
Cell parameters: 5.3007; 19.374; 10.078; 90; 94.012; 90;  

COD ID: 1520250
CIF file Formula: - C8 H8 F N O -
Comments: Huth, Susanne L.; Threlfall, Terry L.; Hursthouse, Michael B. N-(4-fluorophenyl)acetamide Crystal Structure Report Archive (2008) 548
Space group: C 1 c 1
Cell volume: 750.6
Cell parameters: 4.6142; 17.0417; 9.5621; 90; 93.378; 90;  

COD ID: 1520253
CIF file Formula: - C8 H8 F N O -
Comments: Coles, Susanne L.; Threlfall, Terry L.; Hursthouse, Michael B. N-(4-fluorophenyl)acetamide Crystal Structure Report Archive (2008) 1386
Space group: C 1 c 1
Cell volume: 750.6
Cell parameters: 4.6142; 17.0417; 9.5621; 90; 93.378; 90;  

COD ID: 1520396
CIF file Formula: - C9 H12 Cl2 N2 O3 Si -
Comments: Taylor, P. G.; Callear, Samantha K.; Hursthouse, Michael B. C9H12Cl2N2O3Si Crystal Structure Report Archive (2009) 662
Space group: C 1 c 1
Cell volume: 1283.7
Cell parameters: 10.6695; 17.3082; 7.7714; 90; 116.56; 90;  

COD ID: 1520403
CIF file Formula: - C9 H8 N2 O -
Comments: Coles, Susanne L.; Threlfall, Terry L.; Hursthouse, Michael B. N-(4-cyanophenyl)acetamide Crystal Structure Report Archive (2009) 1401
Space group: C 1 c 1
Cell volume: 806.2
Cell parameters: 3.8456; 22.19; 9.448; 90; 90.048; 90;  

COD ID: 1520465
CIF file Formula: - C9 H8 F3 N O2 -
Comments: Coles, Susanne L.; Threlfall, Terry L.; Hursthouse, Michael B. N-[4-(trifluoromethoxy)phenyl]acetamide Crystal Structure Report Archive (2010) 1400
Space group: C 1 c 1
Cell volume: 948.1
Cell parameters: 4.4884; 22.168; 9.5284; 90; 90.048; 90;  

COD ID: 1520482
CIF file Formula: - C13 H0 F5 N -
Comments: Tizzard, G.; Threlfall, T.; Ling, S.; Coles, S. (E)-2,4,6-trifluoro-N-(2,3-difluorobenzylidene)aniline Crystal Structure Report Archive (2010) 1427
Space group: C 1 c 1
Cell volume: 2206.8
Cell parameters: 3.6878; 48.796; 12.4014; 90; 98.55; 90;  

COD ID: 1520966
CIF file Formula: - Fe O9 P3 -
Comments: Elbouaanani, L.K.; Malaman, B.; Gerardin, R. Structure refinement and magnetic properties of C - Fe (P O3)3 studied by neutron diffraction and Mossbauer techniques Journal of Solid State Chemistry 148 (1999) 455-463
Space group: C 1 c 1
Cell volume: 1884.89
Cell parameters: 13.148; 19.076; 9.41; 90; 127; 90;  

COD ID: 1521022
CIF file Formula: - F9 Sb Xe2 -
Comments: Fir, B.A.; Gerken, M.; Dixon, D.A.; Mercier, H.P.A.; Pointner, B.E.; Schrobilgen, G.J.D. An X-ray crystallographic study of (Xe2 F3) (Sb F6) and dimorphism in (Xe2 F3) (As F6): and a density functional theory study of the (Xe2 F3)(+) cation Journal of Fluorine Chemistry 105 (2000) 159-167
Space group: C 1 c 1
Cell volume: 899.82
Cell parameters: 14.575; 8.1081; 9.9926; 90; 130.36; 90;  

COD ID: 1521139
CIF file Formula: - Br Cu6 P S5 -
Comments: Haznar, A.; Pietraszko, A.; Studenyak, I.P. X-ray study of the superionic phase transition in Cu6 P S5 Br Solid State Ionics 119 (1999) 31-36
Space group: C 1 c 1
Cell volume: 905.455
Cell parameters: 11.8147; 6.816; 11.92; 90; 109.391; 90;  

COD ID: 1521209
CIF file Formula: - D1.94 V2 Zr -
Comments: Irodova, A.V.; Suard, E. Evolution of hydrogen superstructure with k = (1/2,1/2,1/2) in Zr V2 D2+d, -0.8<d<0.2 Journal of Alloys Compd. 291 (1999) 184-189
Space group: C 1 c 1
Cell volume: 445.57
Cell parameters: 9.3249; 5.4133; 9.3415; 90; 109.106; 90;  

COD ID: 1521210
CIF file Formula: - D2.18 V2 Zr -
Comments: Irodova, A.V.; Suard, E. Evolution of hydrogen superstructure with k = (1/2,1/2,1/2) in Zr V2 D2+d, -0.8<d<0.2 Journal of Alloys Compd. 291 (1999) 184-189
Space group: C 1 c 1
Cell volume: 449.306
Cell parameters: 9.3564; 5.4265; 9.3709; 90; 109.205; 90;  

COD ID: 1521211
CIF file Formula: - D1.922 Hf V2 -
Comments: Irodova, A.V.; Suard, E. Evolution of hydrogen superstructure with k = (1/2,1/2,1/2) in Zr V2 D2+d, -0.8<d<0.2 Journal of Alloys Compd. 291 (1999) 184-189
Space group: C 1 c 1
Cell volume: 432.47
Cell parameters: 9.2301; 5.3616; 9.2448; 90; 109.043; 90;  

COD ID: 1523213
CIF file Formula: - Co Na4 O3 -
Comments: Barker, M.G.; Fairhall, G.A. The preparation and crystal structure of the ternary oxides Na4 Co O3 and Na10 Co4 O9 Journal of Chemical Research (Synopsis) 1979 (1979) 371-371
Space group: C 1 c 1
Cell volume: 469.531
Cell parameters: 10.993; 5.749; 8.13; 90; 113.96; 90;  

COD ID: 1524469
CIF file Formula: - Al3.88 Ca0.88 H2 Na0.12 O12 Si2.12 -
Comments: Guggenheim, S.; Bailey, S.W. Refinement of the margerite structure in the subgroup symmetry: correction, further refinement and comments American Mineralogist 63 (1978) 186-187
Space group: C 1 c 1
Cell volume: 858.893
Cell parameters: 5.1038; 8.8287; 19.148; 90; 95.46; 90;  

COD ID: 1525443
CIF file Formula: - Cs F3 H O1.5 V -
Comments: Waltersson, K. The crystal structure of Cs V O F3 (H2 O)0.5 Journal of Solid State Chemistry 28 (1979) 121-131
Space group: C 1 c 1
Cell volume: 967.492
Cell parameters: 7.71; 19.474; 7.216; 90; 116.75; 90;  

COD ID: 1526187
CIF file Formula: - Cu2 S3 Sn -
Comments: Onoda, M.; Chen, X.-A.; Sato, A.; Wada, H. Crystal structure and twinning of monoclinic Cu2 Sn S3 Materials Research Bulletin 35 (2000) 1563-1570
Space group: C 1 c 1
Cell volume: 482.56
Cell parameters: 6.653; 11.537; 6.665; 90; 109.39; 90;  

COD ID: 1526401
CIF file Formula: - C3 H9 Al3 N O14 P3 -
Comments: Roux, M.T.; Paillaud, J.L.; Marichal, C.; Fernandez, C.; Baerlocher, C.; Chezeau, J.M. Structural investigation by multinuclear solid state NMR and X-ray diffraction of as-synthesized, dehydrated, and calcined Al P O4 - SOD J. Phys. Chem. B 105 (2001) 9083-9092
Space group: C 1 c 1
Cell volume: 1389.27
Cell parameters: 12.948; 12.483; 8.639; 90; 95.76; 90;  

COD ID: 1526943
CIF file Formula: - H28 Na4 O14 S4 Sn -
Comments: Willett, R. D.; Vij, A.; Imhof, J. M.; Cleary, D. A. Redetermination of the crystal structure of [Na~4~(H~2~O)~14~]SnS~4~: a compound containing a novel chain of aquated sodium ions Journal of Chemical Crystallography 30(6) (2000) 405-410
Space group: C 1 c 1
Cell volume: 2158.15
Cell parameters: 8.621; 23.543; 11.358; 90; 110.58; 90;  

COD ID: 1527091
CIF file Formula: - O5 V3 -
Comments: Asbrink, S.; Friberg, S.; Magneli, A.; Andersson, G. Note on the crystal structure of trivanadium pentoxide Acta Chemica Scandinavica (1-27,1973-42,1988) 13 (1959) 603-603
Space group: C 1 c 1
Cell volume: 325.368
Cell parameters: 9.98; 5.03; 9.84; 90; 138.8; 90;  

COD ID: 1527159
CIF file Formula: - Cu Ga Se0.65 Te1.35 -
Comments: Bocelli, G.; Calestani, C.; de Melo, A.; Leccabue, F.; Watts, B.E.; Pelosi, C. Crystalographic properties of some ternary and multinary Te-based semiconductors Journal of Crystal Growth 113 (1991) 663-668
Space group: C 1 c 1
Cell volume: 1233.14
Cell parameters: 20.454; 8.382; 7.193; 90; 90.61; 90;  

COD ID: 1527544
CIF file Formula: - Fe Na4 O3 -
Comments: Hoppe, R.; Rieck, H. Zur Kenntnis von Na4 (Fe O3) Zeitschrift fuer Anorganische und Allgemeine Chemie 437 (1977) 95-104
Space group: C 1 c 1
Cell volume: 479.539
Cell parameters: 10.967; 5.82; 8.224; 90; 114; 90;  

COD ID: 1527686
CIF file Formula: - Cd4 S6 Si -
Comments: Krebs, B.; Mandt, J. Struktur und Eigenschaften von Cd4 Si S6 Zeitschrift fuer Anorganische und Allgemeine Chemie 388 (1972) 193-206
Space group: C 1 c 1
Cell volume: 1002.29
Cell parameters: 12.31; 7.041; 12.336; 90; 110.38; 90;  

COD ID: 1527856
CIF file Formula: - Ga Se2 Tl -
Comments: Mueller, D.; Hahn, H. Zur Struktur des Tl Ga Se2 Zeitschrift fuer Anorganische und Allgemeine Chemie 438 (1978) 258-272
Space group: C 1 c 1
Cell volume: 1786.28
Cell parameters: 10.772; 10.771; 15.636; 90; 100.06; 90;  

COD ID: 1527900
CIF file Formula: - S Ti0.685 -
Comments: Onoda, M.; Saeki, M.; Kawada, I. Superstructures of Ti2 S3 (4H) Zeitschrift fuer Anorganische und Allgemeine Chemie 457 (1979) 62-74
Space group: C 1 c 1
Cell volume: 1398.74
Cell parameters: 5.9439; 10.295; 22.858; 90; 90; 90;  

COD ID: 1527901
CIF file Formula: - S Ti0.662 -
Comments: Onoda, M.; Kawada, I.; Saeki, M. Superstructures of Ti2 S3 (4H) Zeitschrift fuer Anorganische und Allgemeine Chemie 457 (1979) 62-74
Space group: C 1 c 1
Cell volume: 2133.21
Cell parameters: 10.286; 5.9383; 34.924; 90; 90; 90;  

COD ID: 1527998
CIF file Formula: - Cr H12 O10 P -
Comments: Rodek, E.; Sterzel, W.; Theile, N. Kristalline Chrom(III)-Phosphat-Hexahydrate Zeitschrift fuer Anorganische und Allgemeine Chemie 462 (1980) 42-48
Space group: C 1 c 1
Cell volume: 1576.84
Cell parameters: 9.874; 6.891; 23.49; 90; 99.4; 90;  

COD ID: 1528411
CIF file Formula: - C3 H9 Cl3 Ga O P -
Comments: Cheng Fei; Codgbrook, H.L.; Zhang Wenjian; Hector, A.L.; Reid, G.; Webster, M.; Levason, W. Gallium(III) halide complexes with phosphines, arsines and phosphine oxides - a comparative study Polyhedron 26 (2007) 4147-4155
Space group: C 1 c 1
Cell volume: 995.219
Cell parameters: 8.144; 10.216; 12.418; 90; 105.577; 90;  

COD ID: 1529030
CIF file Formula: - C2 H9 Mn N O7 P2 -
Comments: Yang, B.-P.; Prosvirin, A.V.; Mao, J.-G.; Zhao, H.-H. Syntheses and crystal structures of a series of new divalent metal phosphonates with imino-bis(methylphosphonic acid) Journal of Solid State Chemistry 179 (2006) 175-185
Space group: C 1 c 1
Cell volume: 773.274
Cell parameters: 6.7478; 8.8651; 12.988; 90; 95.569; 90;  

COD ID: 1529420
CIF file Formula: - C21 H23 Cl F2 N2 O -
Comments: Chen, Qiao; Zhou, Jiawei; Wang, Yanan; Wang, Chao; Liu, Xihong; Xu, Zhaoqing; Lin, Li; Wang, Rui Transition-Metal-Free Dehydrosilylative Difluoroamidation of Tetrahydroisoquinolines under Mild Conditions. Organic letters 17(17) (2015) 4212-4215
Space group: C 1 c 1
Cell volume: 1949.6
Cell parameters: 13.1195; 25.1207; 6.0786; 90; 103.299; 90;  

COD ID: 1529450
CIF file Formula: - C14 H10 I N -
Comments: Messaoud, Mohamed Yacine Ameur; Bentabed-Ababsa, Ghenia; Hedidi, Madani; Derdour, Aïcha; Chevallier, Floris; Halauko, Yury S.; Ivashkevich, Oleg A.; Matulis, Vadim E.; Picot, Laurent; Thiéry, Valérie; Roisnel, Thierry; Dorcet, Vincent; Mongin, Florence Deproto-metallation of N-arylated pyrroles and indoles using a mixed lithium-zinc base and regioselectivity-computed CH acidity relationship. Beilstein journal of organic chemistry 11 (2015) 1475-1485
Space group: C 1 c 1
Cell volume: 1185.54
Cell parameters: 7.08; 20.666; 8.2442; 90; 100.632; 90;  

COD ID: 1529761
CIF file Formula: - Cs6 Gd2 O24 S6 -
Comments: Chibiskova, N.T.; Palkina, K.K.; Storozhenko, D.A.; Maksimova, N.V.; Skorikov, V.M.; Shevchuk, V.G. Structure of crystals of the bisulfate (Cs2 S O4)3 Gd2 (S O4)3 Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy 20 (1984) 1944-1946
Space group: C 1 c 1
Cell volume: 2678.85
Cell parameters: 27.333; 10.139; 10.099; 90; 106.83; 90;  

COD ID: 1529902
CIF file Formula: - Li O4 P Zn -
Comments: Elfakir, A.; Souron, J.P.; Robert, F.; Quarton, M. Structure cristalline de l'orthophosphate Li Zn P O4 Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie C, Sciences Chimiques (1966-) 309 (1989) 199-203
Space group: C 1 c 1
Cell volume: 2682.37
Cell parameters: 17.266; 9.738; 17.092; 90; 111.03; 90;  

COD ID: 1529913
CIF file Formula: - C2 F6 Na2 O4 Sb2 -
Comments: Escande, P.; Fourcade, R.; Tichit, D.; Ducourant, M.B.; Mascherpa, G. Interaction paire electronique libre-liaison pi dans un systeme non symetrique. Structure cristalline de Na2 C2 O4 (Sb F3)2 Annales de Chimie (Paris) 1978 (1978) 124-124
Space group: C 1 c 1
Cell volume: 883.619
Cell parameters: 17.213; 6.342; 8.168; 90; 97.7; 90;  

COD ID: 1530079
CIF file Formula: - H4 Mg2 Ni -
Comments: Hayakawa, H.; Ishido, Y.; Ono, S.; Uruno, H.; Nomura, K. Phase transformations among the polymorphs of Mg2 Ni H4 Journal of the Less-Common Metals 103 (1984) 277-283
Space group: C 1 c 1
Cell volume: 548.749
Cell parameters: 15.0374; 6.4114; 6.4932; 90; 118.768; 90;  

COD ID: 1530182
CIF file Formula: - Cs2 Hf Mo3 O12 -
Comments: Klevtsova, R.F.; Antonova, A.A.; Glinskaya, L.A. Crystal structure of Cs2 Hf (Mo O4)3 Kristallografiya 25 (1980) 161-164
Space group: C 1 c 1
Cell volume: 1397.28
Cell parameters: 19.341; 6.95; 10.782; 90; 105.4; 90;  

COD ID: 1530206
CIF file Formula: - Ce H8 N2 O15 P5 -
Comments: Krasnikov, V.V.; Vaivada, M.; Konstant, Z.A. Synthesis of Cerium Phosphates by Thermal Polycondensation of Mixtures CeO2 - NH4H2PO4 and Investigation of Their Structure Journal of Solid State Chemistry 74 (1988) 1-8
Space group: C 1 c 1
Cell volume: 1349.23
Cell parameters: 8.598; 11.733; 13.375; 90; 90.48; 90;  

COD ID: 1530492
CIF file Formula: - Ca H2 O5 Si Zn -
Comments: Nikitin, A.V.; Belov, N.V. The crystal structure of clinohedrite Ca2 Zn2 (O H)2 Si2 O7 = (Ca Zn (Si O4))2 (H2 O) Doklady Akademii Nauk SSSR 148 (1963) 1386-1388
Space group: C 1 c 1
Cell volume: 443.944
Cell parameters: 5.16; 15.94; 5.41; 90; 86.1; 90;  

COD ID: 1530543
CIF file Formula: - Na3 Nd O8 V2 -
Comments: Parent, C.; Fava, J.; Lemaitre-Blaise, M.; Vlasse, M.; le Flem, G.; Salmon, R.; Hagenmuller, P.; Caro, P.; Antic-Fidancev, E. Les vanadates Na3 Ln (V O4)2 (Ln = Pr, Nd, Sm, Eu, Gd, Tb) Nouveau Journal de Chimie 3 (1979) 523-527
Space group: C 1 c 1
Cell volume: 2309.01
Cell parameters: 29.14; 5.574; 14.22; 90; 91.4; 90;  

COD ID: 1530651
CIF file Formula: - H4 Hf Na4 O18 S4 -
Comments: Rogachev, D.L.; Sadikov, G.G.; Dikareva, L.M.; Kuznetsov, V.J. The structure of hafnium and sodium disulfate Hf (S O4)2 (Na2 S O4)2 (H2 O)2 Zhurnal Strukturnoi Khimii (Issue-No. from 1981) 22 (1981) 191-194
Space group: C 1 c 1
Cell volume: 1542.24
Cell parameters: 8.786; 9.907; 17.73; 90; 92.09; 90;  

COD ID: 1530655
CIF file Formula: - C N Rb -
Comments: Rowe, J.M.; Rush, J.J.; Luty, F. Crystal structure of rubidium cyanide at 4 K determined by neutron powder diffraction Physical Review, Serie 3. B - Condensed Matter (18,1978-) 29 (1984) 2168-2170
Space group: C 1 c 1
Cell volume: 306.44
Cell parameters: 7.8; 4.876; 9.527; 90; 122.25; 90;  

COD ID: 1530771
CIF file Formula: - Ca H2 O5 Si Zn -
Comments: Simonov, M.A.; Belokoneva, E.L.; Egorov-Tismenko, Yu.K.; Belov, N.V. The crystal structure of Clinohedrite Ca Zn (Si O4) (H2 O) Doklady Akademii Nauk SSSR 237 (1977) 334-337
Space group: C 1 c 1
Cell volume: 431.076
Cell parameters: 5.131; 15.928; 5.422; 90; 103.39; 90;  

COD ID: 1531124
CIF file Formula: - B4 Cl H2 O8 Pr -
Comments: Belokoneva, E.L.; Stefanovich, S.Yu.; Dimitrova, O.V.; Ivanova, A.G. New nonlinear optical crystals of Ln (B4 O6 (O H)2) Cl (Ln = Pr, Nd) and their structural relation to pentaborates in terms of the OD theory Zhurnal Neorganicheskoi Khimii 47 (2002) 370-377
Space group: C 1 c 1
Cell volume: 681.089
Cell parameters: 6.502; 11.214; 9.682; 90; 105.25; 90;  

COD ID: 1531125
CIF file Formula: - B4 Cl H2 Nd O8 -
Comments: Belokoneva, E.L.; Ivanova, A.G.; Dimitrova, O.V.; Stefanovich, S.Yu. New nonlinear optical crystals of Ln (B4 O6 (O H)2) Cl (Ln = Pr, Nd) and their structural relation to pentaborates in terms of the OD theory Zhurnal Neorganicheskoi Khimii 47 (2002) 370-377
Space group: C 1 c 1
Cell volume: 672.941
Cell parameters: 6.486; 11.156; 9.641; 90; 105.28; 90;  

COD ID: 1531360
CIF file Formula: - C60 F18 -
Comments: Goldt, I.V.; Boltalina, O.V.; Kemnitz, E.; Sidorov, L.N.; Troyanov, S.I. Preparation and crystal structure of solvent free C60 F18 Solid State Sciences 4 (2002) 1395-1401
Space group: C 1 c 1
Cell volume: 3591.42
Cell parameters: 19.66; 11.037; 19.352; 90; 121.21; 90;  

COD ID: 1531466
CIF file Formula: - Hg4 S6 Si -
Comments: Gulay, L.D.; Olekseyuk, I.D.; Parasyuk, O.V. Crystal structure of the Hg4 Si S6 and Hg4 Si Se6 compounds Journal of Alloys Compd. 347 (2002) 115-120
Space group: C 1 c 1
Cell volume: 1010.04
Cell parameters: 12.302; 7.1031; 12.2791; 90; 109.721; 90;  

COD ID: 1531469
CIF file Formula: - Hg4 Se6 Si -
Comments: Gulay, L.D.; Olekseyuk, I.D.; Parasyuk, O.V. Crystal structure of the Hg4 Si S6 and Hg4 Si Se6 compounds Journal of Alloys Compd. 347 (2002) 115-120
Space group: C 1 c 1
Cell volume: 1138.09
Cell parameters: 12.811; 7.4034; 12.7471; 90; 109.721; 90;  

COD ID: 1532045
CIF file Formula: - Cd4 Se6 Si -
Comments: Parasyuk, O.V.; Olekseyuk, I.D.; Piskach, L.V.; Gulay, L.D. Phase diagrams of the (Ag2 Se) - (Zn (Cd) Se) - (Si Se2) systems and crystal structure of the Cd4 Si Se6 compound Journal of Alloys Compd. 354 (2003) 138-142
Space group: C 1 c 1
Cell volume: 1136.73
Cell parameters: 12.8266; 7.3591; 12.8197; 90; 110.052; 90;  

COD ID: 1532421
CIF file Formula: - Co F Fe O4 P -
Comments: Yu, Ranbo; Wang, Dan; Takei, Takahiro; Koizumi, Hitoshi; Kumada, Nobuhiro; Kinomura, Nobukazu Crystal Structure of a Novel Iron-Cobalt Phosphate Fluoride Journal of the Society of Inorganic Materials, Japan 9(297) (2002) 99-104
Space group: C 1 c 1
Cell volume: 722.59
Cell parameters: 12.968; 6.444; 9.818; 90; 118.27; 90;  

COD ID: 1532689
CIF file Formula: - Cu2 Se3 Sn -
Comments: Delgado, G.E.; Mora, A.J.; Marcano, G.; Rincon, C. Crystal structure refinement of the semiconducting compound Cu2 Sn Se3 from X-ray powder diffraction data Materials Research Bulletin 38 (2003) 1949-1955
Space group: C 1 c 1
Cell volume: 550.643
Cell parameters: 6.967; 12.0493; 6.9453; 90; 109.19; 90;  

COD ID: 1532817
CIF file Formula: - C H20 Na2 O13 -
Comments: Libowitzky, E.; Giester, G. Washing soda (natron), Na2 C O3 * 10(H2 O) revised: crystal structures at low and ambient temperatures Mineralogy and Petrology 77 (2003) 177-195
Space group: C 1 c 1
Cell volume: 1269.35
Cell parameters: 12.74; 8.816; 12.571; 90; 115.97; 90;  

COD ID: 1532820
CIF file Formula: - C H20.24 Na2 O13.12 -
Comments: Libowitzky, E.; Giester, G. Washing soda (natron), Na2 C O3 * 10(H2 O) revised: crystal structures at low and ambient temperatures Mineralogy and Petrology 77 (2003) 177-195
Space group: C 1 c 1
Cell volume: 1300.51
Cell parameters: 12.75; 9.001; 12.59; 90; 115.83; 90;  

COD ID: 1533075
CIF file Formula: - Ca H5 O6 P -
Comments: Sainz-Diaz, C.I.; Villacampa, A.; Otalora, F. Crystallographic properties of the calcium phosphate mineral, brushite, by means of first principles calculations American Mineralogist 89 (2004) 307-313
Space group: C 1 c 1
Cell volume: 497.74
Cell parameters: 6.41; 15.18; 5.86; 90; 119.2; 90;  

COD ID: 1533535
CIF file Formula: - Al5.99 H19.74 Na6.68 O105.87 Se9.82 Si41.96 -
Comments: Simoncic, P.; Armbruster, T. Se incorporated into zeolite mordenite-Na : a single-crystal X-ray study Microporous and Mesoporous Materials 71 (2004) 185-198
Space group: C 1 c 1
Cell volume: 2786.94
Cell parameters: 18.077; 20.509; 7.5172; 90; 90.03; 90;  

COD ID: 1534266
CIF file Formula: - Te3 Tl2 -
Comments: Bhan, S.; Schubert, K. Kristallstruktur von Tl5 Te3 und Tl2 Te3 Journal of the Less-Common Metals 20 (1970) 229-235
Space group: C 1 c 1
Cell volume: 658.29
Cell parameters: 17.413; 6.552; 7.91; 90; 133.16; 90;  

COD ID: 1534424
CIF file Formula: - H9 N5 O6 S3 -
Comments: Rustad, D. S. The Synthesis and Some Properties of Diammonium Hydrogentrisulfimide (Diammonium 2-Hydrogen,1,3,5,2,4,6-Trithiatriazine,1,1,3,3,5,5-Hexoxide), (NH4)2HN3S3O6, and the X-Ray Structure of the Hydrogentrisulfimide Ion Phosphorus, Sulfur, Silicon and Related Elements 178 (2003) 235-243
Space group: C 1 c 1
Cell volume: 888.524
Cell parameters: 7.318; 13.092; 9.441; 90; 100.79; 90;  

COD ID: 1534726
CIF file Formula: - C4 Ag2 N4 S4 Zn -
Comments: Lu, S.-F.; He, M.-Y.; Huang, J.-L. The Crystal Structure of Bimetallic Zinc(II) Silver(I) Tetrathiocyanate Complex Zn Ag2 (S C N)4 Journal of Structural Chemistry (China) 1 (1982) 71-76
Space group: C 1 c 1
Cell volume: 1182.08
Cell parameters: 19.72; 7.712; 7.823; 90; 96.5; 90;  

COD ID: 1534844
CIF file Formula: - P5 Rb3 S18 Zr2 -
Comments: Gutzmann, A.; Naether, C.; Bensch, W. Synthesis, crystal structure and optical properties of A3 Zr2 P5 S18 (A = Rb, Cs): the first quaternary zirconium thiophosphates Solid State Sciences 6 (2004) 205-211
Space group: C 1 c 1
Cell volume: 3055.36
Cell parameters: 9.2479; 9.86; 33.622; 90; 94.73; 90;  

COD ID: 1534845
CIF file Formula: - Cl4 H8 O4 Sn -
Comments: Shihada, A.-F.; Abushamleh, A.S.; Weller, F. Crystal structures and Raman spectra of cis-(Sn Cl4 (H2 O)2). 2(H2 O), cis-(Sn Cl4 (H2 O)2) . 3(H2 O), (Sn2 Cl6 (O H)2 (H2 O)2) . 4(H2 O), and (HL) (Sn Cl5 (H2 O)). 2.5(H2 O) (L=3-acetyl-5-benzyl-1-phenyl-4,5-dihydro-1,2,4-triazine-6-one oxime, C18 H18 N4 O2) loop Zeitschrift fuer Anorganische und Allgemeine Chemie 630 (2004) 841-847
Space group: C 1 c 1
Cell volume: 1875.68
Cell parameters: 24.0253; 6.728; 11.6293; 90; 93.787; 90;  

COD ID: 1534848
CIF file Formula: - Cs3 P5 S18 Zr2 -
Comments: Gutzmann, A.; Naether, C.; Bensch, W. Synthesis, crystal structure and optical properties of A3 Zr2 P5 S18 (A = Rb, Cs): the first quaternary zirconium thiophosphates Solid State Sciences 6 (2004) 205-211
Space group: C 1 c 1
Cell volume: 3141.03
Cell parameters: 9.2882; 9.956; 34.061; 90; 94.26; 90;  

COD ID: 1534940
CIF file Formula: - Cl8 O2 Se4 Te3 W2 -
Comments: Beck, J.; Schloerb, T. Polymers in the form of linked rings - a novel type of structures for chalcogen polycations. The crystal structures of (Se4.85 Te3.15) (W O Cl4)2 and (Se4 Te3) (W O Cl4)2 Phosphorus, Sulfur, Silicon and Related Elements 124 (1997) 125-305
Space group: C 1 c 1
Cell volume: 1974.03
Cell parameters: 11.987; 10.72; 15.639; 90; 100.8; 90;  

COD ID: 1535393
CIF file Formula: - Cs20 O12 Si3 Sn8 -
Comments: Hoch, C.; Roehr, C. Akalimetall-Stannid-Silicate und -Germanate: "Doppelsalze" mit dem Zintl-Anion (Sn4)(4-) Zeitschrift fuer Anorganische und Allgemeine Chemie 628 (2002) 1541-1548
Space group: C 1 c 1
Cell volume: 5607.98
Cell parameters: 23.3186; 13.4014; 18.389; 90; 102.61; 90;  

COD ID: 1535897
CIF file Formula: - O12 Rb3 S3 Tm -
Comments: Iskhakova, L.D.; Gasanov, Yu.M. Double sulfates M3 TR (S O4)3 (M= K, Rb) with frame-structure Zhurnal Strukturnoi Khimii (Issue-No. from 1981) 32 (1991) 110-115
Space group: C 1 c 1
Cell volume: 1239.24
Cell parameters: 10.649; 15.149; 9.32; 90; 124.49; 90;  

COD ID: 1535959
CIF file Formula: - Ba H4 N2 -
Comments: Jacobs, H.; Hadenfeldt, C. Die Kristallstruktur von Bariumamid, Ba (N H2)2 Zeitschrift fuer Anorganische und Allgemeine Chemie 418 (1975) 132-140
Space group: C 1 c 1
Cell volume: 665.491
Cell parameters: 8.951; 12.67; 7.037; 90; 123.5; 90;  

COD ID: 1536049
CIF file Formula: - H7.94 La N5 O18.97 Rb1.69 -
Comments: Vigdorchik, A.G.; Malinovskii, Yu.A.; Stefanovich, S.Yu.; Kalinin, V.B.; Dryuchko, A.G.; Verin, I.A. Synthesis and X-ray investigation of rubidium rare earth nitrates Rb2(Ln(NO3)5(H2O)2)(H2O)2 , where Ln=La,Ce. Kristallografiya 37 (1992) 1449-1462
Space group: C 1 c 1
Cell volume: 1748.24
Cell parameters: 11.092; 8.984; 17.863; 90; 100.85; 90;  

COD ID: 1536052
CIF file Formula: - H8 La N5 O19 Rb2 -
Comments: Vigdorchik, A.G.; Malinovskii, Yu.A.; Dryuchko, A.G.; Verin, I.A.; Kalinin, V.B.; Stefanovich, S.Yu. Synthesis and X-ray investigation of rubidium rare earth nitrates Rb2 (Ln (N O3)5 (H2 O)2) * 2(H2 O) , where Ln= La, Ce. Kristallografiya 37 (1992) 1449-1462
Space group: C 1 c 1
Cell volume: 1728.8
Cell parameters: 11.073; 8.945; 17.79; 90; 101.15; 90;  

COD ID: 1536055
CIF file Formula: - Ce H8 N5 O19 Rb1.82 -
Comments: Vigdorchik, A.G.; Stefanovich, S.Yu.; Dryuchko, A.G.; Kalinin, V.B.; Malinovskii, Yu.A.; Verin, I.A. Synthesis and X-ray investigation of rubidium rare earth nitrates Rb2(Ln(NO3)5(H2O)2)*2H2O , where Ln=La,Ce. Kristallografiya 37 (1992) 1449-1462
Space group: C 1 c 1
Cell volume: 1723.22
Cell parameters: 11.027; 8.937; 17.817; 90; 101.06; 90;  

COD ID: 1536058
CIF file Formula: - Ce H8 N5 O19 Rb2 -
Comments: Vigdorchik, A.G.; Malinovskii, Yu.A.; Dryuchko, A.G.; Stefanovich, S.Yu.; Verin, I.A.; Kalinin, V.B. Synthesis and X-ray investigation of rubidium rare earth nitrates Rb2(Ln(NO3)5(H2O)2)*2H2O , where Ln=La,Ce. Kristallografiya 37 (1992) 1449-1462
Space group: C 1 c 1
Cell volume: 1698.66
Cell parameters: 11.003; 8.887; 17.737; 90; 101.65; 90;  

COD ID: 1536395
CIF file Formula: - Na O12 P3 Th2 -
Comments: Kalinin, V.B.; Golubev, A.M.; Stefanovich, S.Yu.; Tafeenko, V.A. Crystal structure and phase transitions in Na Th2 (P O4)3. Kristallografiya 37 (1992) 1220-1226
Space group: C 1 c 1
Cell volume: 943.657
Cell parameters: 17.357; 6.809; 8.133; 90; 100.96; 90;  

COD ID: 1536423
CIF file Formula: - In O9 P3 -
Comments: Palkina, K.K.; Maksimova, S.I.; Chibiskova, N.T.; Chudinova, N.N.; Karmanovskaya, N.B. Crystal structure of indium polyphosphate In (P O3)3-C' Zhurnal Neorganicheskoi Khimii 38 (1993) 1270-1272
Space group: C 1 c 1
Cell volume: 682.07
Cell parameters: 13.55; 6.538; 10.894; 90; 135.03; 90;  

COD ID: 1536467
CIF file Formula: - As K3 Nb2 Se11 -
Comments: Do Jung-Hwan; Kanatzidis, M.G. The noncentrosymmetric chain compounds, A3 M2 As Se11 (A = K, Rb, Cs; M = Nb, Ta) Journal of Alloys Compd. 381 (2004) 41-49
Space group: C 1 c 1
Cell volume: 1887.51
Cell parameters: 14.944; 12.916; 9.945; 90; 100.483; 90;  

COD ID: 1536471
CIF file Formula: - As Nb2 Rb3 Se11 -
Comments: Do Jung-Hwan; Kanatzidis, M. The noncentrosymmetric chain compounds, A3 M2 As Se11 (A = K, Rb, Cs; M = Nb, Ta) Journal of Alloys Compd. 381 (2004) 41-49
Space group: C 1 c 1
Cell volume: 1980.18
Cell parameters: 15.111; 13.2423; 10.0413; 90; 99.768; 90;  

COD ID: 1536475
CIF file Formula: - As Cs3 Nb2 Se11 -
Comments: Do Jung-Hwan; Kanatzidis, M. The noncentrosymmetric chain compounds, A3 M2 As Se11 (A = K, Rb, Cs; M = Nb, Ta) Journal of Alloys Compd. 381 (2004) 41-49
Space group: C 1 c 1
Cell volume: 2113.6
Cell parameters: 15.254; 13.748; 10.187; 90; 98.367; 90;  

COD ID: 1536479
CIF file Formula: - As K3 Se11 Ta2 -
Comments: Do Jung-Hwan; Kanatzidis, M. The noncentrosymmetric chain compounds, A3 M2 As Se11 (A= K, Rb, Cs; M= Nb, Ta) Journal of Alloys Compd. 381 (2004) 41-49
Space group: C 1 c 1
Cell volume: 1888.83
Cell parameters: 14.924; 12.938; 9.9431; 90; 100.319; 90;  

COD ID: 1536513
CIF file Formula: - Cu56.48 Li107 Si60.36 -
Comments: Pavlyuk, V.V.; Pecharskii, V.K.; Kevorkov, D.G.; Bodak, O.I. Crystal structure of Li113 Cu54 Si57 Kristallografiya 40 (1995) 185-187
Space group: C 1 c 1
Cell volume: 3130.73
Cell parameters: 14.12; 24.62; 9.151; 90; 100.22; 90;  

COD ID: 1536723
CIF file Formula: - Cs8 O37 Sb22 -
Comments: Emmerling, F.; Roehr, C. Die Oxoantimonate(III) Rb2 Sb8 O13 und Cs2 Sb22 O37: neue Schicht- und Gerueststrukturen mit "lone-pair"-Kationen Zeitschrift fuer Anorganische und Allgemeine Chemie 628 (2002) 1218-1225
Space group: C 1 c 1
Cell volume: 2875.63
Cell parameters: 12.9993; 7.1987; 30.899; 90; 96; 90;  

COD ID: 1536789
CIF file Formula: - C3 Ca1.5 F Mn0.5 Na3 O9 -
Comments: Yamnova, N.A.; Pushcharovskii, D.Yu.; Khomyakov, A.P.; Vyatkin, S.V. Crystal structure of a new natural fluorocarbonate Na3 Ca (Mn, Ca) (C O3)3 F Kristallografiya 36 (1991) 30-33
Space group: C 1 c 1
Cell volume: 872.3
Cell parameters: 8.012; 15.79; 7.019; 90; 100.78; 90;  

COD ID: 1536810
CIF file Formula: - Na O3 V -
Comments: Ramani, K.; Shaikh, A.M.; Viswamitra, M.A.; Reddy, B.S. Crystal structure of ferroelectric sodium metavanadate, Na V O3 Ferroelectrics 9 (1975) 49-56
Space group: C 1 c 1
Cell volume: 549.472
Cell parameters: 10.494; 9.434; 5.863; 90; 108.8; 90;  

COD ID: 1537184
CIF file Formula: - C K -
Comments: Rowe, J.M.; Rush, J.J.; Susman, S. Neutron powder diffraction study of phase transitions and structures of (K C N)x (K Br)1-x mixed crystals Physical Review, Serie 3. B - Condensed Matter (18,1978-) 28 (1983) 3506-3511
Space group: C 1 c 1
Cell volume: 273.736
Cell parameters: 7.96; 4.59; 9.18; 90; 125.3; 90;  

COD ID: 1537188
CIF file Formula: - C K -
Comments: Rowe, J.M.; Susman, S.; Rush, J.J. Neutron powder diffraction study of phase transitions and structures of (K C N)x (K Br)1-x mixed crystals Physical Review, Serie 3. B - Condensed Matter (18,1978-) 28 (1983) 350-3511
Space group: C 1 c 1
Cell volume: 256.568
Cell parameters: 7.47; 4.53; 8.97; 90; 122.3; 90;  

COD ID: 1537192
CIF file Formula: - C K -
Comments: Rowe, J.M.; Rush, J.J.; Susman, S. Neutron powder diffraction study of ohase transitions and structures of (K C N)x (K Br)1-x nixed crystals Physical Review, Serie 3. B - Condensed Matter (18,1978-) 28 (1983) 3506-3511
Space group: C 1 c 1
Cell volume: 267.412
Cell parameters: 8.02; 4.21; 10.4; 90; 130.4; 90;  

COD ID: 1537196
CIF file Formula: - C0.95 K -
Comments: Rowe, J.M.; Rush, J.J.; Susman, S. Neutron powder diffraction study of ohase transitions and structures of (K C N)x (K Br)1-x mixed crystals Physical Review, Serie 3. B - Condensed Matter (18,1978-) 28 (1983) 3506-3511
Space group: C 1 c 1
Cell volume: 270.915
Cell parameters: 7.59; 4.6; 9.18; 90; 122.3; 90;  

COD ID: 1537199
CIF file Formula: - C0.95 K -
Comments: Rowe, J.M.; Rush, J.J.; Susman, S. Neutron powder diffraction study of phase transitions and structures of (K C N)x (K Br)1-x mixed crystals Physical Review, Serie 3. B - Condensed Matter (18,1978-) 28 (1983) 3506-3511
Space group: C 1 c 1
Cell volume: 275.984
Cell parameters: 8.04; 4.34; 10.34; 90; 130.1; 90;  

COD ID: 1537203
CIF file Formula: - Ce2 K O16 S4 -
Comments: Kuznetsov, V.Ya.; Dikareva, L.M.; Porai-Koshits, M.A.; Rogachev, D.L. Structure of K Ce(III) Ce(IV) (S O4)4 Zhurnal Strukturnoi Khimii (Issue-No. from 1981) 31 (1990) 14-18
Space group: C 1 c 1
Cell volume: 1268.43
Cell parameters: 11.734; 15.695; 9.268; 90; 132; 90;  

COD ID: 1537204
CIF file Formula: - C0.9 K -
Comments: Rowe, J.M.; Susman, S.; Rush, J.J. Neutron powder diffraction study of phase transitions and structures of (K C N)x (K Br)1-x mixed crystals Physical Review, Serie 3. B - Condensed Matter (18,1978-) 28 (1983) 3506-3511
Space group: C 1 c 1
Cell volume: 271.563
Cell parameters: 7.6; 4.6; 9.2; 90; 122.4; 90;  

COD ID: 1537206
CIF file Formula: - C0.9 K -
Comments: Rowe, J.M.; Rush, J.J.; Susman, S. Neutron powder diffraction study of phase transitions and structures of (K C N)x (K Br)1-x mixed crystals Physical Review, Serie 3. B - Condensed Matter (18,1978-) 28 (1983) 3506-3511
Space group: C 1 c 1
Cell volume: 250.364
Cell parameters: 7.48; 4.24; 10.29; 90; 129.9; 90;  

COD ID: 1537209
CIF file Formula: - C0.9 K -
Comments: Rowe, J.M.; Rush, J.J.; Susman, S. Neutron powder diffraction study of nhase transitions and structures of (K C N)x (K Br)1-x mixed crystals Physical Review, Serie 3. B - Condensed Matter (18,1978-) 28 (1983) 356-3511
Space group: C 1 c 1
Cell volume: 250.595
Cell parameters: 7.45; 4.22; 10.39; 90; 129.9; 90;  

COD ID: 1537213
CIF file Formula: - C0.8 K -
Comments: Rowe, J.M.; Susman, S.; Rush, J.J. Neutron powder diffraction study of phase transitions and structures of (K C N)x (K Br)1-x mixed crystals Physical Review, Serie 3. B - Condensed Matter (18,1978-) 28 (1983) 3506-3511
Space group: C 1 c 1
Cell volume: 272.141
Cell parameters: 7.65; 4.6; 9.19; 90; 122.7; 90;  

COD ID: 1539508
CIF file Formula: - Br7 In5 -
Comments: Staffel, T.; Meyer, G. In5 Br7, the second mixed-valence In(I) - In(II) bromide: In(I)3 (In(II)2 Br6) Br Zeitschrift fuer Anorganische und Allgemeine Chemie 563 (1988) 27-37
Space group: C 1 c 1
Cell volume: 6476.65
Cell parameters: 18.688; 18.602; 19.217; 90; 104.19; 90;  

COD ID: 1539649
CIF file Formula: - Cr H6 O7 S -
Comments: Dahmen, T.; Schmidt, G.; Glaum, R.; Gruehn, R. Zur Darstellung und Kristallstruktur von Cr S O4 (H2 O)3 Zeitschrift fuer Anorganische und Allgemeine Chemie 586 (1990) 141-148
Space group: C 1 c 1
Cell volume: 560.307
Cell parameters: 5.7056; 13.211; 7.485; 90; 96.73; 90;  

COD ID: 1539820
CIF file Formula: - C2 Ce Co -
Comments: Bodak, O.I.; Marusin, E.P.; Bruskov, V.A. The crystal structure of compounds R Co C2 (R= Ce, La or Pr) Soviet Physics, Crystallography (= Kristallografiya) 25 (1980) 355-356
Space group: C 1 c 1
Cell volume: 211.755
Cell parameters: 7.455; 5.3857; 5.3885; 90; 101.83; 90;  

COD ID: 1539967
CIF file Formula: - H Mn3 O8.5 P2 -
Comments: Yakubovich, O.V.; Massa, W.; Soboleva, A.A.; Dimitrova, O.V.; Urusov, V.S. Crystal structure of a new synthetic homologue of the switzerite series Doklady Akad. Nauk 393 (2003) 197-204
Space group: C 1 c 1
Cell volume: 1321.76
Cell parameters: 9.31; 17.414; 8.161; 90; 92.58; 90;  

COD ID: 1540025
CIF file Formula: - C28 H29 Dy N10 O10 Zn -
Comments: Anastasiadis, Nikolaos C.; Polyzou, Christina D.; Kostakis, George E.; Bekiari, Vlasoula; Lan, Yanhua; Perlepes, Spyros P.; Konidaris, Konstantis F.; Powell, Annie K. Dinuclear lanthanide(iii)/zinc(ii) complexes with methyl 2-pyridyl ketone oxime. Dalton transactions (Cambridge, England : 2003) 44(46) (2015) 19791-19795
Space group: C 1 c 1
Cell volume: 3332.6
Cell parameters: 15.9387; 9.3158; 22.5168; 90; 94.59; 90;  

COD ID: 1540152
CIF file Formula: - Ce2 H3 O17 Se4 -
Comments: Iskhakova, L.D.; Tursina, A.I. Crystal stucture of (H3 O) (CeIII CeIV (Se O4)4) Kristallografiya 34 (1989) 1414-1418
Space group: C 1 c 1
Cell volume: 1434.5
Cell parameters: 12.297; 16.267; 9.295; 90; 129.51; 90;  

COD ID: 1540186
CIF file Formula: - C138 H112 Cu2 N4 S -
Comments: Zhai, Junjie; Filatov, Alexander S.; Hillhouse, Gregory L.; Hopkins, Michael D. Synthesis, structure, and reactions of a copper‒sulfido cluster comprised of the parent Cu2S unit: {(NHC)Cu}2(μ-S) Chem. Sci. 7(1) (2016) 589
Space group: C 1 c 1
Cell volume: 10753.8
Cell parameters: 20.1366; 18.5935; 28.856; 90; 95.5214; 90;  

COD ID: 1540193
CIF file Formula: - C102 H132 B Mg2 N6 O2 -
Comments: Weetman, Catherine; Anker, Mathew D.; Arrowsmith, Merle; Hill, Michael S.; Kociok-Köhn, Gabriele; Liptrot, David J.; Mahon, Mary F. Magnesium-catalysed nitrile hydroboration Chem. Sci. 7(1) (2016) 628
Space group: C 1 c 1
Cell volume: 9630
Cell parameters: 12.3279; 30.1877; 26.5175; 90; 102.622; 90;  

COD ID: 1540487
CIF file Formula: - C31 H51 Cl2 F6 N O3 P3 Pd -
Comments: Mitsushige, Yusuke; Carrow, Brad P.; Ito, Shingo; Nozaki, Kyoko Ligand-controlled insertion regioselectivity accelerates copolymerisation of ethylene with methyl acrylate by cationic bisphosphine monoxide‒palladium catalysts Chem. Sci. 7(1) (2016) 737
Space group: C 1 c 1
Cell volume: 3765.1
Cell parameters: 8.2128; 22.725; 20.504; 90; 100.299; 90;  

COD ID: 1540698
CIF file Formula: - C70 H83 As3 Dy3 -
Comments: Pugh, Thomas; Vieru, Veacheslav; Chibotaru, Liviu F.; Layfield, Richard A. Magneto-structural correlations in arsenic- and selenium-ligated dysprosium single-molecule magnets Chem. Sci. 7(3) (2016) 2128
Space group: C 1 c 1
Cell volume: 6406
Cell parameters: 14.9242; 18.6105; 23.7155; 90; 103.461; 90;  

COD ID: 1540700
CIF file Formula: - C70 H83 Dy3 Se3 -
Comments: Pugh, Thomas; Vieru, Veacheslav; Chibotaru, Liviu F.; Layfield, Richard A. Magneto-structural correlations in arsenic- and selenium-ligated dysprosium single-molecule magnets Chem. Sci. 7(3) (2016) 2128
Space group: C 1 c 1
Cell volume: 6280
Cell parameters: 14.8845; 18.4953; 23.4214; 90; 103.098; 90;  

COD ID: 1540701
CIF file Formula: - C70 H83 Se3 Y3 -
Comments: Pugh, Thomas; Vieru, Veacheslav; Chibotaru, Liviu F.; Layfield, Richard A. Magneto-structural correlations in arsenic- and selenium-ligated dysprosium single-molecule magnets Chem. Sci. 7(3) (2016) 2128
Space group: C 1 c 1
Cell volume: 6266
Cell parameters: 14.9029; 18.4253; 23.423; 90; 103.035; 90;  

COD ID: 1540814
CIF file Formula: - Cd H8 O10 V2 -
Comments: Ulicka, L. Crystal structure of Cd (V O3)2 (H2 O)4 and its comparison with the structure of Ca (V O3)2 (H2 O)4 and alpha-Cd (V O3)2 Chemical Papers 42 (1988) 11-19
Space group: C 1 c 1
Cell volume: 902.49
Cell parameters: 13.319; 10.344; 7.041; 90; 111.51; 90;  

COD ID: 1540852
CIF file Formula: - K3 Li Na2 O6 Te -
Comments: Wisser, T.; Hoppe, R. Das erste Quinquinaere Oxotellurate(VI): K3 Na2 Li Te O6 Zeitschrift fuer Anorganische und Allgemeine Chemie 586 (1990) 125-135
Space group: C 1 c 1
Cell volume: 746.461
Cell parameters: 9.283; 11.874; 6.787; 90; 93.8; 90;  

COD ID: 1540873
CIF file Formula: - La P2 -
Comments: von Schnering, H.G.; Wichelhaus, W.; Nahrup, M.S. Lanthandiphosphid La P2; Darstellung, Struktur und Eigenschaften Zeitschrift fuer Anorganische und Allgemeine Chemie 412 (1975) 193-201
Space group: C 1 c 1
Cell volume: 1093.19
Cell parameters: 12.505; 13.942; 8.883; 90; 135.1; 90;  

COD ID: 1540893
CIF file Formula: - C2 Co Pr -
Comments: Schaefer, W.; Kockelmann, W.; Linhart, J.; Will, G.; Kotsanidis, P.A.; Yakinthos, J.K. Structural and magnetic properties of R Co C2 (R = Pr, Dy, Ho) compounds studied by neutron diffraction Journal of Magnetism and Magnetic Materials 132 (1994) 243-248
Space group: C 1 c 1
Cell volume: 207.993
Cell parameters: 7.401; 5.358; 5.357; 90; 101.73; 90;  

COD ID: 1541808
CIF file Formula: - Al4 H2 Li Na O12 Si2 -
Comments: Slade, P.G.; Radoslovich, E.W. The structure of an ephesite-2M1 in spacegroup Cc Neues Jahrbuch fuer Mineralogie. Monatshefte (Band=Jahr) (1950-) 1985 (1985) 337-352
Space group: C 1 c 1
Cell volume: 870.939
Cell parameters: 5.114; 8.865; 19.29; 90; 95.19; 90;  

COD ID: 1541827
CIF file Formula: - Ca H8 Na2 O11 P2 -
Comments: Cheng, P.T.; Nyburg, S.C.; Adams, M.E.; Pritzker, K.P.H. beta-Calcium disodium pyrophosphate tetrahydrate, Ca Na2 P2 O7 * 4 H2 O Crystal Structure Communications 8 (1979) 313-317
Space group: C 1 c 1
Cell volume: 981.612
Cell parameters: 10.38; 16.98; 5.75; 90; 104.4; 90;  

COD ID: 1541879
CIF file Formula: - Ge2.052 In1.948 S8 -
Comments: Zheng Nanfeng; Feng Pingyun; Bu Xianhui; Wang Bing Microporous and photoluminescent chalcogenide zeolite analogs Science 298 (2002) 2366-2369
Space group: C 1 c 1
Cell volume: 2595.23
Cell parameters: 16.354; 16.035; 12.835; 90; 129.551; 90;  

COD ID: 1542065
CIF file Formula: - C4 H6 K N4 Na O3 Pt -
Comments: Moreau-Colin, M.L. La structure cristalline du tetracyanoplatinate de potassium et sodium trihydrate Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977) 91 (1968) 332-338
Space group: C 1 c 1
Cell volume: 1047.52
Cell parameters: 11.77; 13.74; 6.5; 90; 94.783; 90;  

COD ID: 1542319
CIF file Formula: - C24 H20 La N O9 -
Comments: Gong, Yun-Nan; Ouyang, Ting; He, Chun-Ting; Lu, Tong-Bu Photoinduced water oxidation by an organic ligand incorporated into the framework of a stable metal‒organic framework Chem. Sci. 7(2) (2016) 1070
Space group: C 1 c 1
Cell volume: 2060.96
Cell parameters: 18.4394; 13.7828; 8.116; 90; 92.319; 90;  

COD ID: 1542400
CIF file Formula: - C24 H38 Br2 K O U -
Comments: Lichtscheidl, Alejandro; Pagano, Justin; Scott, Brian; Nelson, Andrew; Kiplinger, Jaqueline Expanding the Chemistry of Actinide Metallocene Bromides. Synthesis, Properties and Molecular Structures of the Tetravalent and Trivalent Uranium Bromide Complexes: (C5Me4R)2UBr2, (C5Me4R)2U(O-2,6-iPr2C6H3)(Br), and [K(THF)][(C5Me4R)2UBr2] (R = Me, Et) Inorganics 4(1) (2016) 1
Space group: C 1 c 1
Cell volume: 2771.2
Cell parameters: 11.0688; 29.295; 8.7573; 90; 102.609; 90;  

COD ID: 1542427
CIF file Formula: - C31 H19 N3 -
Comments: Zhang, Dongdong; Cai, Minghan; Bin, Zhengyang; Zhang, Yunge; Zhang, Deqiang; Duan, Lian Highly efficient blue thermally activated delayed fluorescent OLEDs with record-low driving voltages utilizing high triplet energy hosts with small singlet‒triplet splittings Chem. Sci. 7(5) (2016) 3355
Space group: C 1 c 1
Cell volume: 2186.2
Cell parameters: 16.7003; 14.0892; 9.3429; 90; 96.029; 90;  

COD ID: 1542486
CIF file

Original IUCr paper

 Formula: - C21 H22 Br N O4 -
Comments: Abdelhamid, Antar A.; Mohamed, Shaaban K.; Simpson, Jim 9-(5-Bromo-2-hydroxyphenyl)-10-(2-hydroxyethyl)-3,4,6,7-tetrahydroacridine-1,8(2<i>H</i>,5<i>H</i>,9<i>H</i>,10<i>H</i>)-dione IUCrData 1(1) (2016) x152425
Space group: C 1 c 1
Cell volume: 1802.17
Cell parameters: 16.0067; 8.9455; 16.1617; 90; 128.853; 90;  

COD ID: 1542625
CIF file Formula: - C23 H16 N2 O -
Comments: Yang, Changjiang; Chen, Xiangyu; Tang, Tong; He, Zhengjie Annulation Reaction of 3-Acylmethylidene Oxindoles with Huisgen Zwitterions and Its Applications in the Syntheses of Pyrrolo[4,3,2-de]quinolinones and Marine Alkaloids Ammosamides. Organic letters 18(6) (2016) 1486-1489
Space group: C 1 c 1
Cell volume: 1685.9
Cell parameters: 5.5058; 26.046; 11.867; 90; 97.83; 90;  

COD ID: 1542767
CIF file Formula: - C45 H56 Cl4 Cs2 N20 O13 Zn -
Comments: Wei, Lian Tong; Zhang, Yun Qian; Zhou, Kai Zhi; Zhan, Lin Ling; Qu, Yun Xia; Tao, Zhu; Ma, Pei Hua Coordination of fully substituted cyclopentano cucurbit[5]uril with alkali cation in the presence of tetrachloridezicate anion Inorganica Chimica Acta 445 (2016) 1-7
Space group: C 1 c 1
Cell volume: 5621.7
Cell parameters: 16.17; 15.723; 22.381; 90; 98.896; 90;  

COD ID: 1542770
CIF file Formula: - C45 H56 Cl4 N20 O13 Rb2 Zn -
Comments: Wei, Lian Tong; Zhang, Yun Qian; Zhou, Kai Zhi; Zhan, Lin Ling; Qu, Yun Xia; Tao, Zhu; Ma, Pei Hua Coordination of fully substituted cyclopentano cucurbit[5]uril with alkali cation in the presence of tetrachloridezicate anion Inorganica Chimica Acta 445 (2016) 1-7
Space group: C 1 c 1
Cell volume: 5522.8
Cell parameters: 16.032; 15.689; 22.294; 90; 99.974; 90;  

COD ID: 1542779
CIF file Formula: - C54 H42 N2 O8 Zn2 -
Comments: Nalla, Venkatram; Medishetty, Raghavender; Wang, Yue; Bai, Zhaozhi; Sun, Handong; Wei, Ji.; Vittal, Jagadese J. Second harmonic generation from the `centrosymmetric' crystals IUCrJ 2(3) (2015) 317-321
Space group: C 1 c 1
Cell volume: 4507.9
Cell parameters: 24.843; 12.245; 15.7202; 90; 109.498; 90;  

COD ID: 1542780
CIF file Formula: - C54 H42 N2 O8 Zn2 -
Comments: Nalla, Venkatram; Medishetty, Raghavender; Wang, Yue; Bai, Zhaozhi; Sun, Handong; Wei, Ji.; Vittal, Jagadese J. Second harmonic generation from the `centrosymmetric' crystals IUCrJ 2(3) (2015) 317-321
Space group: C 1 c 1
Cell volume: 4467.2
Cell parameters: 24.746; 12.2117; 15.6525; 90; 109.192; 90;  

COD ID: 1542781
CIF file Formula: - C54 H42 N2 O8 Zn2 -
Comments: Nalla, Venkatram; Medishetty, Raghavender; Wang, Yue; Bai, Zhaozhi; Sun, Handong; Wei, Ji.; Vittal, Jagadese J. Second harmonic generation from the `centrosymmetric' crystals IUCrJ 2(3) (2015) 317-321
Space group: C 1 c 1
Cell volume: 4503
Cell parameters: 24.817; 12.241; 15.714; 90; 109.39; 90;  

COD ID: 1542782
CIF file Formula: - C54 H42 N2 O8 Zn2 -
Comments: Nalla, Venkatram; Medishetty, Raghavender; Wang, Yue; Bai, Zhaozhi; Sun, Handong; Wei, Ji.; Vittal, Jagadese J. Second harmonic generation from the `centrosymmetric' crystals IUCrJ 2(3) (2015) 317-321
Space group: C 1 c 1
Cell volume: 4418.7
Cell parameters: 24.638; 12.1718; 15.5632; 90; 108.782; 90;  

COD ID: 1542783
CIF file Formula: - C54 H42 N2 O8 Zn2 -
Comments: Nalla, Venkatram; Medishetty, Raghavender; Wang, Yue; Bai, Zhaozhi; Sun, Handong; Wei, Ji.; Vittal, Jagadese J. Second harmonic generation from the `centrosymmetric' crystals IUCrJ 2(3) (2015) 317-321
Space group: C 1 c 1
Cell volume: 4376.8
Cell parameters: 24.525; 12.1433; 15.4964; 90; 108.492; 90;  

COD ID: 1542885
CIF file

HKL data

 Formula: - C19 H16 O -
Comments: Adam, Farook; Ameram, Nadiah; Kamath, Shevgoor Dhiraj; Pallavi; Samshuddin, Seranthimata 4-Benzyloxy-1,1'-biphenyl IUCrData 1(3) (2016) x160398
Space group: C 1 c 1
Cell volume: 1379.58
Cell parameters: 31.27; 5.672; 7.8812; 90; 99.271; 90;  

COD ID: 1542984
CIF file

HKL data

Original IUCr paper

 Formula: - C28 H25 N3 O3 S -
Comments: Mague, Joel T.; Mohamed, Shaaban K.; Akkurt, Mehmet; Bakhite, Etify A.; Albayati, Mustafa R. Ethyl 3-({[(4-methylphenyl)carbamoyl]methyl}sulfanyl)-5,6-diphenylpyridazine-4-carboxylate IUCrData 1(3) (2016) x160479
Space group: C 1 c 1
Cell volume: 2530.56
Cell parameters: 10.2254; 26.6695; 9.921; 90; 110.718; 90;  

COD ID: 1543247
CIF file Formula: - C34 H35 N5 O Si -
Comments: Gerlach, Daniela; Brendler, Erica; Wagler, Jörg Hexacoordinate Silicon Compounds with a Dianionic Tetradentate (N,N′,N′,N)-Chelating Ligand Inorganics 4(2) (2016) 8
Space group: C 1 c 1
Cell volume: 2874.2
Cell parameters: 14.5651; 22.872; 10.4529; 90; 124.37; 90;  

COD ID: 1543289
CIF file Formula: - C67 H141 K O22 S Si4 U -
Comments: Andrez, Julie; Pécaut, Jacques; Scopelliti, Rosario; Kefalidis, Christos E.; Maron, Laurent; Rosenzweig, Michael W.; Meyer, Karsten; Mazzanti, Marinella Synthesis and reactivity of a terminal uranium(iv) sulfide supported by siloxide ligands Chem. Sci. 7(9) (2016) 5846
Space group: C 1 c 1
Cell volume: 8891
Cell parameters: 13.8962; 24.5807; 26.1417; 90; 95.317; 90;  

COD ID: 1543462
CIF file

HKL data

Original IUCr paper

 Formula: - C8 H11 F6 N3 O6 S2 -
Comments: Partl, Gabriel; Lampl, Martin; Laus, Gerhard; Wurst, Klaus; Huppertz, Hubert; Schottenberger, Herwig 1,3-Dimethoxy-2-methylimidazolium bis(trifluoromethanesulfonyl)imide IUCrData 1(5) (2016) x160824
Space group: C 1 c 1
Cell volume: 1706.51
Cell parameters: 12.4858; 14.0212; 9.848; 90; 98.179; 90;  

COD ID: 1543901
CIF file

HKL data

 Formula: - C21 H21 O3 P Se -
Comments: Raymundo, Melina; Padgett, Clifford W.; Lynch, Will E. Tris(4-methoxyphenyl)phosphine selenide IUCrData 1(8) (2016) x161271
Space group: C 1 c 1
Cell volume: 2008
Cell parameters: 16.442; 10.991; 11.722; 90; 108.611; 90;  

COD ID: 1544258
CIF file Formula: - C16 H39 Li O6 Si3 -
Comments: Li, H.; Aquino, A. J. A.; Cordes, D. B.; Hase, W. L.; Krempner, C. Electronic nature of zwitterionic alkali metal methanides, silanides and germanides - a combined experimental and computational approach. Chemical science 8(2) (2017) 1316-1328
Space group: C 1 c 1
Cell volume: 2494
Cell parameters: 9.531; 17.403; 15.039; 90; 90.873; 90;  


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