Crystallography Open Database

Result : There are 281 entries in the selection

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Searching space group like 'A b a 2'

COD ID: 1004029
CIF file Formula: - C5 H16 Ga6 N2 O27 P6 -
Comments: Josien, L.; Simon, A.; Gramlich, V.; Patarin, J. Synthesis and characterization of the new hydroxygallophosphate Mu-18 with a framework topology closely related to that of the hydroxyaluminophosphate AlPO~4^-^~EN3 Chemistry of Materials 13(4) (2001) 1305-1311
Space group: A b a 2
Cell volume: 2710
Cell parameters: 18.035; 10.513; 14.293; 90; 90; 90;  

COD ID: 1011124
CIF file Formula: - B5 H8 K O12 -
Comments: Zachariasen, W. H. The crystal structure of potassium acid dihydronium pentaborate KH~2~(H~3~O)~2~B~5~O~10~, (potassium pentaborate tetrahydrate) Zeitschrift für Kristallographie - Crystalline Materials 98(1-6) (1938) 266-274
Space group: A b a 2
Cell volume: 1107.2
Cell parameters: 11.08; 11.14; 8.97; 90; 90; 90;  

COD ID: 1100858
CIF file Formula: - C27 H31 Fe2 N O2 Si -
Comments: Busetto, Luigi; Marchetti, Fabio; Zacchini, Stefano; Zanotti, Valerio Deprotonation of μ-Vinyliminium Ligands in Diiron Complexes: A Route for the Synthesis of Mono- and Polynuclear Species Containing Novel Multidentate Ligands Organometallics 24(10) (2005) 2297-2306
Space group: A b a 2
Cell volume: 5144.6
Cell parameters: 9.92; 34.927; 14.849; 90; 90; 90;  

COD ID: 1501635
CIF file Formula: - C25 H12 Br4 -
Comments: Ulrich Darbost; Janie Cabana; Eric Demers; Thierry Maris; James D. Wuest Molecular Tectonics. Use of Br...aryl Supramolecular Interactions for the construction of Organized Networks from 9,9'-spirobifluorene in the Crystalline State. CheM 1 (2011) 52-12369
Space group: A b a 2
Cell volume: 2290.1
Cell parameters: 10.0693; 13.9976; 16.2481; 90; 90; 90;  

COD ID: 1504131
CIF file Formula: - C12 H6 O6 -
Comments: Li, Yan; Lampkins, Andrew J.; Baker, Matthew B.; Sumpter, Bobby G.; Huang, Jingsong; Abboud, Khalil A.; Castellano, Ronald K. Benzotrifuranone: synthesis, structure, and access to polycyclic heteroaromatics. Organic letters 11(19) (2009) 4314-4317
Space group: A b a 2
Cell volume: 4061.7
Cell parameters: 10.4174; 37.939; 10.277; 90; 90; 90;  

COD ID: 1506081
CIF file Formula: - C9 H15 N O4 -
Comments: Persson, Tobias; Nielsen, John Synthesis of N-methoxy-N-methyl-beta-enaminoketoesters: new synthetic precursors for the regioselective synthesis of heterocyclic compounds. Organic letters 8(15) (2006) 3219-3222
Space group: A b a 2
Cell volume: 2086.3
Cell parameters: 17.5451; 16.2722; 7.3076; 90; 90; 90;  

COD ID: 1507519
CIF file Formula: - C16 H11 Cl3 O S3 -
Comments: Marsella, Michael J.; Yoon, Kunsang; Tham, Fook S. Synthesis and Crystal Structure of a Tubular Sexithiophene Organic Letters 3(13) (2001) 2129
Space group: A b a 2
Cell volume: 3557.5
Cell parameters: 24.646; 10.612; 13.602; 90; 90; 90;  

COD ID: 1508019
CIF file Formula: - C29 H25 N5 -
Comments: Bechlars, Bettina; D'Alessandro, Deanna M; Jenkins, David M.; Iavarone, Anthony T.; Glover, Starla D.; Kubiak, Clifford P.; Long, Jeffrey R. High-spin ground states via electron delocalization in mixed-valence imidazolate-bridged divanadium complexes. Nature chemistry 2(5) (2010) 362-368
Space group: A b a 2
Cell volume: 2246.9
Cell parameters: 17.919; 15.19; 8.255; 90; 90; 90;  

COD ID: 1510307
CIF file Formula: - Au Sn4 -
Comments: Gohle, R.; Wolcyrz, M.; Kubiak, R. Refinement of the crystal stuctures of Au Sn4 and Pd Sn4 Journal of the Less-Common Metals 97 (1984) 265-269
Space group: A b a 2
Cell volume: 496.778
Cell parameters: 6.5124; 6.5162; 11.7065; 90; 90; 90;  

COD ID: 1512309
CIF file Formula: - C44 H29 N5 -
Comments: Leung, Man-kit; Hsieh, Yu-Hsuan; Kuo, Ting-Yi; Chou, Pi-Tai; Lee, Jiun-Haw; Chiu, Tien-Lung; Chen, Hsin-Jen Novel Ambipolar Orthogonal Donor‒Acceptor Host for Blue Organic Light Emitting Diodes Organic Letters 15(18) (2013) 4694
Space group: A b a 2
Cell volume: 9785.9
Cell parameters: 22.3172; 27.4649; 15.9655; 90; 90; 90;  

COD ID: 1512643
CIF file Formula: - C12 H12 Co N10 O2 -
Comments: Kari Darling; Wayne Ouellette; Steven Pellizzeri; Tiffany Smith; Jose Vargas; Steven Tomaszfski; Charles J. O-Connor; Jon Zubieta One- and two-dimensional coordination polymers of substituted tetrazoles with cadmium(II) Inorganica Chimica Acta 392 (2012) 417-427
Space group: A b a 2
Cell volume: 1521.12
Cell parameters: 12.6376; 15.9206; 7.5603; 90; 90; 90;  

COD ID: 1512689
CIF file Formula: - C40 H30 Co2 N4 O14 S -
Comments: Guo-Ping Yang; Rui-Ting Liu; Chen Ren; Lei Hou; Yao-Yu Wang; Qi-Zhen Shi Silver(I)/cobalt(II) complexes with mixed V-shaped polycarboxylate and rod-like N-donor ligands: Syntheses, structures and properties Inorganica Chimica Acta 393 (2012) 58-64
Space group: A b a 2
Cell volume: 4191.1
Cell parameters: 17.335; 26.819; 9.015; 90; 90; 90;  

COD ID: 1513952
CIF file Formula: - C57 H59 N O2 -
Comments: Bock, Harald; Subervie, Daniel; Mathey, Pierre; Pradhan, Anirban; Sarkar, Parantap; Dechambenoit, Pierre; Hillard, Elizabeth A.; Durola, Fabien Helicenes from diarylmaleimides. Organic letters 16(6) (2014) 1546-1549
Space group: A b a 2
Cell volume: 28126
Cell parameters: 23.975; 82.044; 14.299; 90; 90; 90;  

COD ID: 1514198
CIF file Formula: - C27 H24 Cl2 N4 -
Comments: Jiang, Ting; Zhang, Ping; Yu, Changjiang; Yin, Jian; Jiao, Lijuan; Dai, En; Wang, Jun; Wei, Yun; Mu, Xiaolong; Hao, Erhong Straightforward Synthesis of Oligopyrroles through a Regioselective SNAr Reaction of Pyrroles and Halogenated Boron Dipyrrins. Organic letters 16(7) (2014) 1952-1955
Space group: A b a 2
Cell volume: 5503.3
Cell parameters: 26.511; 27.724; 7.4876; 90; 90; 90;  

COD ID: 1514932
CIF file Formula: - C15 H11 N S -
Comments: Das, Sudipta; Sahana, Animesh; Banerjee, Arnab; Lohar, Sisir; Guha, Subarna; Matalobos, Jesús Sanmartín; Das, Debasis Thiophene anchored naphthalene derivative: Cr3+ selective turn-on fluorescent probe for living cell imaging Analytical Methods 4(8) (2012) 2254
Space group: A b a 2
Cell volume: 2379.7
Cell parameters: 10.7541; 20.966; 10.5543; 90; 90; 90;  

COD ID: 1515160
CIF file Formula: - C16 H8 O4 -
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: A b a 2
Cell volume: 3670.12
Cell parameters: 8.8594; 8.8592; 46.7607; 90; 90; 90;  

COD ID: 1515657
CIF file Formula: - C25 H20 B F10 N -
Comments: Schwendemann, Sina; Fröhlich, Roland; Kehr, Gerald; Erker, Gerhard Intramolecular frustrated N/B lewis pairs by enamine hydroboration Chemical Science 2(9) (2011) 1842
Space group: A b a 2
Cell volume: 4730
Cell parameters: 17.8309; 21.5961; 12.2832; 90; 90; 90;  

COD ID: 1515733
CIF file Formula: - C23 H22 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: A b a 2
Cell volume: 7134.2
Cell parameters: 17.1668; 25.851; 16.076; 90; 90; 90;  

COD ID: 1516130
CIF file Formula: - C39 H32 N4 O6 S2 -
Comments: Nayak, Sanatan; Ghosh, Nayan; Sahoo, Akhila K. Access to Cyclobutene-Fused Azepines through Au-Catalyzed Cycloisomerization of Stable Alkyne Tethered Ketene N,N-Acetals. Organic letters 16(11) (2014) 2996-2999
Space group: A b a 2
Cell volume: 7774.7
Cell parameters: 15.0516; 28.646; 18.0316; 90; 90; 90;  

COD ID: 1516824
CIF file Formula: - C26 H20 Cu N6 O4 -
Comments: Satyajit Mondal; Sumita Naskar; Ayan Kumar Dey; Ekkehard Sinn; Carla Eribal; Steven R. Herron; Shyamal Kumar Chattopadhyay Mononuclear and binuclear Cu(II) complexes of some tridentate aroyl hydrazones. X-ray crystal structures of a mononuclear and a binuclear complex Inorganica Chimica Acta 398 (2013) 98-105
Space group: A b a 2
Cell volume: 2413.39
Cell parameters: 12.576; 17.8297; 10.7632; 90; 90; 90;  

COD ID: 1521962
CIF file Formula: - Bi2 Ge0.2 O5.4 V0.8 -
Comments: Sooryanarayana, K.; Guru Row, T.N.; Varma, K.B.R. Structural phase transitions in Bi2 V1-x Gex Co5.5-x/2 (x = 0.2, 0.4 and 0.6) single crystals: X-ray crystallographic study Materials Research Bulletin 34 (1999) 425-432
Space group: A b a 2
Cell volume: 474.259
Cell parameters: 5.577; 15.346; 5.5414; 90; 90; 90;  

COD ID: 1522306
CIF file Formula: - Pd Sn4 -
Comments: Kubiak, R.; Wolcyrz, M. Refinement of the crystal structures of Au Sn4 and Pd Sn4 Journal of the Less-Common Metals 97 (1984) 265-269
Space group: A b a 2
Cell volume: 471.051
Cell parameters: 6.3888; 6.4415; 11.4462; 90; 90; 90;  

COD ID: 1522861
CIF file Formula: - Pd0.89 Sn2 -
Comments: Schubert, K.; Pfisterer, H. Zur Kristalchemie der B-Metall-reichsten Phasen in Legierungen von Uebergansmetallen der Eisen- und Platintriaden mit Elementen der 4. Nebengruppe Zeitschrift fuer Metallkunde 41 (1950) 433-441
Space group: A b a 2
Cell volume: 510.078
Cell parameters: 6.478; 6.478; 12.155; 90; 90; 90;  

COD ID: 1522862
CIF file Formula: - Pt Sn4 -
Comments: Schubert, K.; Roesler, U. Die Kristallstruktur von Pt Sn4 Zeitschrift fuer Metallkunde 41 (1950) 298-300
Space group: A b a 2
Cell volume: 467.84
Cell parameters: 6.397; 6.426; 11.381; 90; 90; 90;  

COD ID: 1525794
CIF file Formula: - Bi4 Li2 O12 Ti3 -
Comments: Choy, J.-H.; Chung, I.; Kim, J.-Y. Neutron diffraction and X-ray absorption spectroscopic analyses for lithiated Aurivillius-type layered perovskite oxide, Li2 Bi4 Ti3 O12 J. Phys. Chem. B 105 (2001) 7908-7912
Space group: A b a 2
Cell volume: 965.212
Cell parameters: 5.4091; 32.785; 5.4428; 90; 90; 90;  

COD ID: 1526366
CIF file Formula: - C N4 Si2 -
Comments: Riedel, R.; Greiner, A.; Aldinger, F.; Dressler, W.; Miehe, G.; Fuess, H.; Bill, J. The first crystalline solids in the ternary Si - C - N system Angewandte Chemie (Edition international) 36 (1997) 603-606
Space group: A b a 2
Cell volume: 355.34
Cell parameters: 5.44; 13.58; 4.81; 90; 90; 90;  

COD ID: 1526626
CIF file Formula: - Bi2 O9 Sr Ta2 -
Comments: Kim, J.S.; Cheon, C.-I.; Shim, H.-S.; Lee, C.H. Crystal structure and phase transitions of Sr1+x Bi2+y Ta2 O9 ceramics Journal of the European Ceramic Society 21 (2001) 1295-1298
Space group: A b a 2
Cell volume: 769.318
Cell parameters: 5.533; 25.125; 5.534; 90; 90; 90;  

COD ID: 1528445
CIF file Formula: - Bi4 O12 Ti3 -
Comments: Dorrian, J.F.; Newnham, R.E.; Smith, D.K.jr. Crystal structure of Bi4 Ti3 O12 Ferroelectrics 3 (1971) 17-27
Space group: A b a 2
Cell volume: 967.8
Cell parameters: 32.83; 5.411; 5.448; 90; 90; 90;  

COD ID: 1529518
CIF file Formula: - H15 I10 La3 O37 -
Comments: Abrahams, S.C.; Bernstein, J.L. Pyroelectric (La (I O3)3)3 (H I O3) (H2 O)7. Crystal structure of the transition metal iodates. V. Journal of Chemical Physics 69 (1978) 2505-2513
Space group: A b a 2
Cell volume: 3479.79
Cell parameters: 13.1801; 21.7208; 12.1551; 90; 90; 90;  

COD ID: 1531653
CIF file Formula: - Ge2 Hg3 K2 Se8 -
Comments: Jin, X.-R.; Zhang, L.-D.; Guo, H.-Y.; Shu, G.-M.; Wang, R.-J. Synthesis and characterization of a novel quaternary metal selenide K2 Hg3 Ge2 Se8 Journal of Alloys Compd. 347 (2002) 67-71
Space group: A b a 2
Cell volume: 1709.8
Cell parameters: 19.851; 10.004; 8.6097; 90; 90; 90;  

COD ID: 1531666
CIF file Formula: - Bi2 Nb2 O9 Pb -
Comments: Kim, J.S.; Choo, W.-G.; Cheon, C.-I.; Lee, C.H. Crystal structure of high temperature phase in (Bi2 O2)-layered perovskites A Bi2 M2 O9 (A = Pb, Sr; M = Nb, Ta) Journal of the Korean Ceramic Society 38 (2001) 962-966
Space group: A b a 2
Cell volume: 790.877
Cell parameters: 5.5457; 25.6975; 5.5496; 90; 90; 90;  

COD ID: 1532326
CIF file Formula: - Al F6 H12 N3 -
Comments: Udovenko, A.A.; Laptash, N.M.; Maslenikova, I.G. Orientation disorder in ammonium elpasolites. Crystal structures of(N H4)3 Al F6, (N H4)3 Ti O F5 and (N H4)3 Fe F6 Journal of Fluorine Chemistry 124 (2003) 5-15
Space group: A b a 2
Cell volume: 714.541
Cell parameters: 8.9401; 8.9401; 8.9401; 90; 90; 90;  

COD ID: 1535132
CIF file Formula: - H7 La O10 P2 -
Comments: Ben Moussa, S.; Sanz, J.; Ventemillas, S.; Cabeza, A.; Gutierrez-Puebla, E. Structure of trihydrated rare-earth acid diphosphates Ln H P2 O7 * 3(H2 O) (Ln = La, Er) Journal of Solid State Chemistry 177 (2004) 2129-2137
Space group: A b a 2
Cell volume: 1738.68
Cell parameters: 13.653; 18.526; 6.874; 90; 90; 90;  

COD ID: 1539288
CIF file Formula: - Pd0.875 Sn2 -
Comments: Schubert, K.; Pfisterer, H. Zur Kristallchemie der B-Metall-reichsten Phasen in in Legierungen von Uebergangsmetallen der Eisen- und Platintriaden mit Elementen der vierten Nebengruppe Zeitschrift fuer Metallkunde 41 (1950) 433-433
Space group: A b a 2
Cell volume: 513.139
Cell parameters: 6.491; 6.491; 12.179; 90; 90; 90;  

COD ID: 2000735
CIF file

Original IUCr paper

 Formula: - Bi2 O5.5 V -
Comments: Touboul, M.; Lokaj, J.; Tessier, L.; Kettman, V.; Vrabel, V. Structure of dibismuth vanadate Bi~2~VO~5.5~ Acta Crystallographica Section C 48(7) (1992) 1176-1179
Space group: A b a 2
Cell volume: 473.6
Cell parameters: 5.598; 15.292; 5.532; 90; 90; 90;  

COD ID: 2001269
CIF file

Original IUCr paper

 Formula: - C8 H20 I7 N -
Comments: Tebbe, K.-F.; Gilles, T. Verfeinerung der Kristallstruktur des Tetraethylammoniumheptaiodids Acta Crystallographica Section C 49(11) (1993) 2042-2045
Space group: A b a 2
Cell volume: 2226.8
Cell parameters: 11.511; 15.654; 12.358; 90; 90; 90;  

COD ID: 2005460
CIF file

Original IUCr paper

 Formula: - C12 H10 O4 S -
Comments: Glidewell, C.; Ferguson, G. Interpenetrating Square Nets in the Hydrogen-Bonded Structure of 4,4'-Sulfonyldiphenol Acta Crystallographica Section C 52(10) (1996) 2528-2530
Space group: A b a 2
Cell volume: 2371.7
Cell parameters: 15.048; 19.295; 8.1684; 90; 90; 90;  

COD ID: 2005876
CIF file

Original IUCr paper

 Formula: - C25 H35 N3 O -
Comments: Sudha, L.; Subramanian, K.; Senthil Selvan, J.; Steiner, Th.; Koellner, G.; Ramdas, K.; Srinivasan, N. 1,2-Bis(2,6-diethylphenyl)-3,3-(oxydiethyl)guanidine Acta Crystallographica Section C 53(1) (1997) 88-90
Space group: A b a 2
Cell volume: 4715.1
Cell parameters: 14.978; 16.703; 18.847; 90; 90; 90;  

COD ID: 2005879
CIF file

Original IUCr paper

 Formula: - C40 H38 P2 Pd S2 -
Comments: Su, W.; Hong, M.; Cao, R.; Liu, H. [1,2-Bis(diphenylphosphino)ethane-<i>P</i>,<i>P</i>']bis(α-toluenethiolato-<i>S</i>)palladium(II), [Pd{Ph~2~P(CH~2~)~2~PPh~2~}(SCH~2~Ph)~2~] Acta Crystallographica Section C 53(1) (1997) 66-67
Space group: A b a 2
Cell volume: 3460.7
Cell parameters: 18.07; 21.23; 9.021; 90; 90; 90;  

COD ID: 2006202
CIF file

HKL data

Original IUCr paper

 Formula: - Mo8 O14 Sm -
Comments: Tortelier, J.; Gougeon, P. SmMo~8~O~14~ Acta Crystallographica Section C 53(6) (1997) 668-671
Space group: A b a 2
Cell volume: 1024.89
Cell parameters: 9.193; 9.9973; 11.1516; 90; 90; 90;  

COD ID: 2008440
CIF file

HKL data

Original IUCr paper

 Formula: - C8 H14 Cd O2 S4 -
Comments: Tomlin, David W.; Cooper, Thomas M.; Zelmon, David E.; Gebeyehu, Zewdu; Hughes, John M. Cadmium isopropylxanthate Acta Crystallographica Section C 55(5) (1999) 717-719
Space group: A b a 2
Cell volume: 1394.34
Cell parameters: 20.652; 8.8934; 7.5917; 90; 90; 90;  

COD ID: 2008934
CIF file

Original IUCr paper

 Formula: - C24 H18 O5 S2 -
Comments: S.Shanmuga Sundara Raj; Hoong-Kun Fun; Susmita Gupta; Jayanta Kumar Ray Bis[4-(2-methoxycarbonyl-5-thienyl)]phenyl ether Acta Crystallographica Section C 55(9) (1999) 1517-1519
Space group: A b a 2
Cell volume: 2088.73
Cell parameters: 7.3785; 47.9241; 5.9069; 90; 90; 90;  

COD ID: 2010179
CIF file

Original IUCr paper

 Formula: - C16 H15 N O3 -
Comments: Suh, I-H.; Lim, S-S.; Lee, J-H.; Ryu, B-Y; Kim, M-J.; Yoon, C.S.; Hong, H-K.; Lee, K.S. 4-Methoxy-3-methyl-4'-nitrostilbene, C~16~H~15~NO~3~ Acta Crystallographica Section C 50(11) (1994) 1768-1770
Space group: A b a 2
Cell volume: 2833.5
Cell parameters: 15.75; 13.47; 13.356; 90; 90; 90;  

COD ID: 2011159
CIF file

HKL data

Original IUCr paper

 Formula: - C47 H46 F12 N4 O P4 Ru -
Comments: Venegas-Yazigi, Diego; Mirza, Hameed; Lever, A. B. P.; Lough, Alan J.; Costamagna, Juan; Latorre, Ramón Bis(acetonitrile-<i>N</i>)(<i>o</i>-benzoquinone diimine-<i>N</i>,<i>N</i>')-<i>trans</i>-bis(triphenylphosphine-<i>P</i>)ruthenium(II) bis(hexafluorophosphate) methanol solvate Acta Crystallographica Section C 56(7) (2000) e281-e282
Space group: A b a 2
Cell volume: 4877.5
Cell parameters: 19.0603; 16.596; 15.4192; 90; 90; 90;  

COD ID: 2014246
CIF file

HKL data

Original IUCr paper

 Formula: - C14 H24 N4 O4 -
Comments: Venkatraman, Ramaiyer; Ray, Paresh Chandra; Fronczek, Frank R. The 1:1 adduct of hexamethylenetetramine (HMT) with racemic <i>trans</i>-1,2-cyclohexanedicarboxylic acid (CDA) Acta Crystallographica Section C 60(9) (2004) o633-o635
Space group: A b a 2
Cell volume: 3202.1
Cell parameters: 11.99; 11.814; 22.606; 90; 90; 90;  

COD ID: 2015247
CIF file

HKL data

Original IUCr paper

 Formula: - C13 H10 Cl2 N4 O4 -
Comments: Vasconcelos, Thatyana R. A.; de Souza, Marcus V. N.; Wardell, Solange M. S. V.; Wardell, James L.; Low, John N.; Glidewell, Christopher Hydrogen-bonded framework structures in 4-[(4-chloro-3-nitrobenzoyl)hydrazinocarbonyl]pyridinium chloride and <i>N</i>-3,5-dinitrobenzoyl-<i>N</i>'-isonicotinoylhydrazine Acta Crystallographica Section C 62(4) (2006) o222-o226
Space group: A b a 2
Cell volume: 2891.4
Cell parameters: 15.2414; 22.643; 8.3783; 90; 90; 90;  

COD ID: 2019709
CIF file

HKL data

Original IUCr paper

 Formula: - C15 H10 Cd O6 -
Comments: Chen, Hui-Ru; Zhang, Wen-Wen A novel two-dimensional Cd^II^ coordination polymer: poly[aqua[μ~4~-2-(4-carboxylatobenzoyl)benzoato]cadmium(II)] Acta Crystallographica Section C 70(11) (2014) 1079-1082
Space group: A b a 2
Cell volume: 2712
Cell parameters: 12.664; 30.334; 7.06; 90; 90; 90;  

COD ID: 2019768
CIF file

HKL data

Original IUCr paper

 Formula: - C14 H10 I N O -
Comments: Wang, Lei; Zhang, Man; Jin, Ying-Ying; Lu, Qing; Fang, Qi Three 1-phenylindolin-2-one derivatives displaying different molecular dipole moments and different crystallographic symmetries Acta Crystallographica Section C 71(1) (2015)
Space group: A b a 2
Cell volume: 2474.92
Cell parameters: 8.1164; 13.3844; 22.7824; 90; 90; 90;  

COD ID: 2019787
CIF file

HKL data

Original IUCr paper

 Formula: - C24 H20 Mn N10 O2 -
Comments: Liu, Yan-Fei; Liu, Ya-Ping; Zhang, Ke-Ke; Ren, Qing-Ling; Qin, Jie Mononuclear and three-dimensional metal complexes based on a multidentate hydrazone ligand Acta Crystallographica Section C 71(2) (2015)
Space group: A b a 2
Cell volume: 2358.1
Cell parameters: 12.379; 19.2445; 9.8987; 90; 90; 90;  

COD ID: 2100267
CIF file

Original IUCr paper

 Formula: - C4 H8 O -
Comments: Dave Allan, D The low-temperature and high-pressure crystal structures of cyclobutanol (C~4~H~7~OH) Acta Crystallographica Section B 61(4) (2005) 449-454
Space group: A b a 2
Cell volume: 1749.9
Cell parameters: 9.3789; 13.658; 13.661; 90; 90; 90;  

COD ID: 2100268
CIF file

Original IUCr paper

 Formula: - C4 H8 O -
Comments: Dave Allan, D The low-temperature and high-pressure crystal structures of cyclobutanol (C~4~H~7~OH) Acta Crystallographica Section B 61(4) (2005) 449-454
Space group: A b a 2
Cell volume: 1733.6
Cell parameters: 9.3312; 13.642; 13.619; 90; 90; 90;  

COD ID: 2102342
CIF file

Original IUCr paper

 Formula: - C19 H18 O3 -
Comments: Marsh, Richard E. Space group <i>Cc</i>: an update Acta Crystallographica Section B 60(2) (2004) 252-253
Space group: A b a 2
Cell volume: 1559.66
Cell parameters: 7.4127; 34.03; 6.1829; 90; 90; 90;  

COD ID: 2103973
CIF file

Original IUCr paper

 Formula: - C H3 Na2 O6 -
Comments: Pritchard, Robin Gavin; Islam, Emran Sodium percarbonate between 293 and 100K Acta Crystallographica Section B 59(5) (2003) 596-605
Space group: A b a 2
Cell volume: 973.07
Cell parameters: 9.183; 15.745; 6.73; 90; 90; 90;  

COD ID: 2200274
CIF file

Original IUCr paper

 Formula: - Mo7.7 Nd O14 -
Comments: Barrier, N.; Gougeon, P. NdMo~7.7~O~14~ containing Mo~6~, Mo~7~ and Mo~8~ clusters Acta Crystallographica Section E 57(6) (2001) i46-i48
Space group: A b a 2
Cell volume: 1022.79
Cell parameters: 9.1639; 9.973; 11.1913; 90; 90; 90;  

COD ID: 2201752
CIF file

HKL data

Original IUCr paper

 Formula: - Mo7.62 O14 Pr -
Comments: Barrier, N.; Gougeon, P. The cluster compound PrMo~7.6~O~14~ Acta Crystallographica Section E 59(3) (2003) i28-i30
Space group: A b a 2
Cell volume: 1022.29
Cell parameters: 9.1611; 9.9709; 11.1916; 90; 90; 90;  

COD ID: 2204287
CIF file

HKL data

Original IUCr paper

 Formula: - C28 H28 Sn -
Comments: Howie, R. Alan; Wardell, James L. (2-Methyl-2-phenylpropyl)triphenylstannane Acta Crystallographica Section E 60(10) (2004) m1536-m1538
Space group: A b a 2
Cell volume: 4538.36
Cell parameters: 22.8724; 17.0573; 11.6326; 90; 90; 90;  

COD ID: 2204611
CIF file

HKL data

Original IUCr paper

 Formula: - C35 H32 Cu2 N4 O9 -
Comments: Huo, Li-Hua; Gao, Shan; Zhao, Hui; Ng, Seik Weng Bis(μ-9-oxidofluorene-9-carboxylato-κ^3^<i>O,O</i>':<i>O</i>)bis[aqua(1<i>H</i>-imidazole-κ<i>N</i>^3^)copper(II)] methanol solvate Acta Crystallographica Section E 60(12) (2004) m1747-m1749
Space group: A b a 2
Cell volume: 3378
Cell parameters: 17.228; 14.464; 13.556; 90; 90; 90;  

COD ID: 2205529
CIF file

HKL data

Original IUCr paper

 Formula: - C18 H18 O8 -
Comments: Mao-Lin Hu; Ya-Qian Cheng; Shun Wang; Ji-Xin Yuan; Xiao-Qing Cai 6,6'-Dioxo-2,2-bi(7-oxatricyclo[3.2.1.1^3,8^]nonane)-4,4'-dicarboxylic acid Acta Crystallographica Section E 61(4) (2005) o1196-o1197
Space group: A b a 2
Cell volume: 1574.8
Cell parameters: 9.8562; 13.4978; 11.8371; 90; 90; 90;  

COD ID: 2208670
CIF file

HKL data

Original IUCr paper

 Formula: - C19 H18 O3 -
Comments: Harrison, William T. A.; Sarojini, B. K.; Vijaya Raj, K. K.; Yathirajan, H. S.; Narayana, B. A redetermination of 1,5-bis(4-methoxyphenyl)penta-1,4-dien-3-one at 120(2)K Acta Crystallographica Section E 62(4) (2006) o1522-o1523
Space group: A b a 2
Cell volume: 1498.3
Cell parameters: 7.2756; 33.583; 6.132; 90; 90; 90;  

COD ID: 2208695
CIF file

HKL data

Original IUCr paper

 Formula: - C34 H26 Mn N4 O6 -
Comments: Zi-Qiang Hu; Lian-Bin Wu; Guo-Qiao Lai Bis(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')bis(4-hydroxybenzoato-κ<i>O</i>)manganese(II) Acta Crystallographica Section E 62(4) (2006) m712-m713
Space group: A b a 2
Cell volume: 2956
Cell parameters: 12.948; 21.805; 10.47; 90; 90; 90;  

COD ID: 2209528
CIF file

HKL data

Original IUCr paper

 Formula: - C28 H24 Cu N6 O4 -
Comments: Dang, Dong-Bin; Bai, Yan; Duan, Chun-Ying Bis{<i>N</i>-(2-hydroxybenzoyl)-<i>N</i>'-[1-(2-pyridyl)ethylidene}hydrazinato]copper(II) Acta Crystallographica Section E 62(7) (2006) m1567-m1568
Space group: A b a 2
Cell volume: 2507.1
Cell parameters: 12.57; 18.731; 10.6482; 90; 90; 90;  

COD ID: 2210275
CIF file

HKL data

Original IUCr paper

 Formula: - C28 H24 N6 Ni O4 -
Comments: Dang, Dong-Bin; Bai, Yan; Duan, Chun-Ying Bis{<i>N</i>-(2-hydroxybenzoyl)-<i>N</i>'-[1-(2-pyridyl)ethylidene]hydrazinato}nickel(II) Acta Crystallographica Section E 62(9) (2006) m2290-m2292
Space group: A b a 2
Cell volume: 2461.2
Cell parameters: 12.495; 18.672; 10.549; 90; 90; 90;  

COD ID: 2210543
CIF file

HKL data

Original IUCr paper

 Formula: - C9 H9 Br2 N O2 -
Comments: Sun, Yu-Xi; Zhang, Ran; Tian, Lai-Jin; Xu, Lai-Xiang; Sun Shan-Li 2,4-Dibromo-6-(2-hydroxyethyliminiomethyl)phenolate Acta Crystallographica Section E 62(10) (2006) o4433-o4435
Space group: A b a 2
Cell volume: 2064
Cell parameters: 18.7541; 21.9752; 5.0082; 90; 90; 90;  

COD ID: 2210708
CIF file

HKL data

Original IUCr paper

 Formula: - C16 H13 N O3 S -
Comments: Harrison, William T. A.; Yathirajan, H. S.; Mithun, A.; Narayana, B.; Sarojini, B. K. 3-[4-(Methylsulfanyl)phenyl]-1-(4-nitrophenyl)prop-2-en-1-one Acta Crystallographica Section E 62(10) (2006) o4508-o4509
Space group: A b a 2
Cell volume: 2746.8
Cell parameters: 13.7388; 33.5802; 5.9538; 90; 90; 90;  

COD ID: 2211243
CIF file

HKL data

Original IUCr paper

 Formula: - C9 H9 Cl2 N O2 -
Comments: Ling Huang; Ding-Ben Chen; Duan Qiu; Bo Zhao (<i>E</i>)-2,4-Dichloro-6-[(2-hydroxyethyliminio)methyl]phenolate Acta Crystallographica Section E 62(11) (2006) o5239-o5240
Space group: A b a 2
Cell volume: 1947.9
Cell parameters: 18.619; 21.447; 4.8779; 90; 90; 90;  

COD ID: 2213076
CIF file

HKL data

Original IUCr paper

 Formula: - C14 H15 N O -
Comments: M. Subramanyam; A. Thiruvalluvar; R. T. Sabapathy; S. Kamatchi 3-Cyano-3-methyl-5-phenylcyclohexanone Acta Crystallographica Section E 63(5) (2007) o2715-o2716
Space group: A b a 2
Cell volume: 2287.85
Cell parameters: 11.5745; 17.5499; 11.2629; 90; 90; 90;  

COD ID: 2214777
CIF file

HKL data

Original IUCr paper

 Formula: - C20 H30 Mg2 N8 O9 -
Comments: Stadie, Nicholas P.; Sanchez-Smith, Rebeca; Groy, Thomas L. Di-μ-acetato-κ^4^<i>O</i>:<i>O</i>'-μ-oxido-κ^2^<i>O</i>:<i>O</i>-bis[(acetic acid-κ<i>O</i>)bis(1<i>H</i>-imidazole-κ<i>N</i>^3^)magnesium(II)] Acta Crystallographica Section E 63(8) (2007) m2153-m2154
Space group: A b a 2
Cell volume: 2795.8
Cell parameters: 8.6927; 19.106; 16.834; 90; 90; 90;  

COD ID: 2214918
CIF file

HKL data

Original IUCr paper

 Formula: - C12 H38 Cl2 N4 Ni O4 -
Comments: Zhang, Yu-Zhen; Chen, Zi-Lu; Ng, Seik Weng Diaqua(cyclohexane-1,2-diamine-κ^2^<i>N</i>,<i>N</i>')(<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylethylenediamine-κ^2^<i>N</i>,<i>N</i>')nickel(II) dichloride dihydrate Acta Crystallographica Section E 63(8) (2007) m2228-m2228
Space group: A b a 2
Cell volume: 2121.3
Cell parameters: 14.159; 9.843; 15.221; 90; 90; 90;  

COD ID: 2214940
CIF file

HKL data

Original IUCr paper

 Formula: - C21 H18 Cl4 N4 Ru -
Comments: Al-Noaimi, Mousa; Haddad, Salim F. <i>cis</i>-Bis(2,2'-bipyridyl)dichloridoruthenium(II) dichloromethane solvate Acta Crystallographica Section E 63(9) (2007) m2332-m2332
Space group: A b a 2
Cell volume: 2309.1
Cell parameters: 12.5658; 15.4595; 11.8864; 90; 90; 90;  

COD ID: 2217027
CIF file

HKL data

Original IUCr paper

 Formula: - C18 H13 N2 O2.5 -
Comments: Fang-Fang Jian; Li-Ming Wang; Li Du; Jing Wang <i>N</i>-(4-Aminophenyl)-1,8-naphthalimide hemihydrate Acta Crystallographica Section E 64(1) (2008) o263-o263
Space group: A b a 2
Cell volume: 2810
Cell parameters: 22.926; 17.93; 6.836; 90; 90; 90;  

COD ID: 2218250
CIF file

HKL data

Original IUCr paper

 Formula: - C28 H32 Te2 Zr -
Comments: Hector, Andrew L.; Levason, William; Reid, Gillian; Reid, Stuart D.; Webster, Michael Bis(η^5^-cyclopentadienyl)bis(2,4,6-trimethylphenyltellurolato)zirconium(IV) Acta Crystallographica Section E 64(5) (2008) m667
Space group: A b a 2
Cell volume: 2733.4
Cell parameters: 9.0483; 21.881; 13.806; 90; 90; 90;  

COD ID: 2218533
CIF file

HKL data

Original IUCr paper

 Formula: - C36 H38 Co2 N8 O9 -
Comments: Zimmermann, Iwan; Keene, Tony D.; Neels, Antonia; Decurtins, Silvio Di-μ-acetato-μ-aqua-bis[acetatobis(1<i>H</i>-benzimidazole)cobalt(II)] Acta Crystallographica Section E 64(6) (2008) m845-m846
Space group: A b a 2
Cell volume: 3736.8
Cell parameters: 18.663; 8.8101; 22.727; 90; 90; 90;  

COD ID: 2220929
CIF file

HKL data

Original IUCr paper

 Formula: - C26 H18 Br2 N2 -
Comments: Dehghanpour, Saeed; Asadizadeh, Saeedeh; Gao, Shan; Ng, Seik Weng <i>N</i>,<i>N</i>'-Bis(4-bromobenzylidene)biphenyl-2,2'-diamine Acta Crystallographica Section E 65(2) (2009) o306
Space group: A b a 2
Cell volume: 2236.6
Cell parameters: 15.9691; 8.3482; 16.7767; 90; 90; 90;  

COD ID: 2221522
CIF file

HKL data

Original IUCr paper

 Formula: - C18 H12 N2 O -
Comments: Hassan, Noor Doha; Tajuddin, Hairul Anuar; Abdullah, Zanariah; Ng, Seik Weng 1-Naphthyl quinoxalin-2-yl ether Acta Crystallographica Section E 65(4) (2009) o731
Space group: A b a 2
Cell volume: 2637.16
Cell parameters: 18.2758; 18.5123; 7.7947; 90; 90; 90;  

COD ID: 2221975
CIF file

HKL data

Original IUCr paper

 Formula: - C38 H40 Fe4 O10 -
Comments: Xiao, Yan-Feng; Li, Hong-Feng; Yan, Peng-Fei; Li, Guang-Ming Bis[μ-1,1'-(ferrocene-1,1'-diyl)bis(butane-1,3-dionato)]di-μ-methanol-diiron(II) Acta Crystallographica Section E 65(6) (2009) m624
Space group: A b a 2
Cell volume: 3648.3
Cell parameters: 14.599; 19.29; 12.955; 90; 90; 90;  

COD ID: 2222592
CIF file

HKL data

Original IUCr paper

 Formula: - C14 H10 N2 O -
Comments: Shah Bakhtiar, Nasir; Akmam A. Bakar, Maizathul; Abdullah, Zanariah; Ng, Seik Weng 2-(2-Naphthyloxy)pyrimidine Acta Crystallographica Section E 65(8) (2009) o1881
Space group: A b a 2
Cell volume: 2205.6
Cell parameters: 13.0119; 22.4944; 7.5355; 90; 90; 90;  

COD ID: 2223367
CIF file

HKL data

Original IUCr paper

 Formula: - C18 H20 N4 -
Comments: Rivera, Augusto; Maldonado, Mauricio; Ríos-Motta, Jaime; González-Salas, Diego; Dacunha-Marinho, Bruno 2,9-Dimethyl-6<i>H</i>,13<i>H</i>-5:12,7:14-dimethanodibenzo[<i>d</i>,<i>i</i>][1,3,6,8]tetraazecine Acta Crystallographica Section E 65(10) (2009) o2553
Space group: A b a 2
Cell volume: 1446.37
Cell parameters: 9.9777; 18.8351; 7.6963; 90; 90; 90;  

COD ID: 2223665
CIF file

HKL data

Original IUCr paper

 Formula: - C15 H11 N S -
Comments: Tao, Xuquan; Cui, Hui <i>N</i>-(2-Thienylmethylene)naphthalen-1-amine Acta Crystallographica Section E 65(11) (2009) o2779
Space group: A b a 2
Cell volume: 2457.7
Cell parameters: 10.7793; 21.26; 10.7244; 90; 90; 90;  

COD ID: 2226460
CIF file

HKL data

Original IUCr paper

 Formula: - C52 H62 Gd N11 O18 S2 -
Comments: Hao, Lujiang; Zhang, Xiaofei; Chen, Jiangkui (4-Aminobenzenesulfonato)heptaaquagadolinium(III) 4-aminobenzenesulfonate nitrate 4,4'-bipyridyl tetrasolvate dihydrate Acta Crystallographica Section E 66(7) (2010) m740-m741
Space group: A b a 2
Cell volume: 11897.3
Cell parameters: 33.529; 23.3375; 15.2046; 90; 90; 90;  

COD ID: 2227908
CIF file

HKL data

Original IUCr paper

 Formula: - C28 H26 Hg N8 O6 -
Comments: Rofouei, Mohammad Kazem; Fereyduni, Ehsan; Attar Gharamaleki, Jafar; Bruno, Giuseppe; Amiri Rudbari, Hadi Bis[1-(2-ethoxyphenyl)-3-(4-nitrophenyl)triazenido]mercury(II) Acta Crystallographica Section E 66(9) (2010) m1082
Space group: A b a 2
Cell volume: 2827.96
Cell parameters: 15.4637; 18.6594; 9.8008; 90; 90; 90;  

COD ID: 2228239
CIF file

HKL data

Original IUCr paper

 Formula: - C14 H15 Cl N2 O3 S -
Comments: Bühler, Stefanie; Schollmeyer, Dieter; Albrecht, Wolfgang; Laufer, Stefan <i>N</i>-(4-Chloropyridin-2-yl)-<i>N</i>-methoxymethyl-4-methylbenzenesulfonamide Acta Crystallographica Section E 66(12) (2010) o3321
Space group: A b a 2
Cell volume: 3081.2
Cell parameters: 15.1651; 22.7953; 8.9132; 90; 90; 90;  

COD ID: 2229882
CIF file

HKL data

Original IUCr paper

 Formula: - C13 H19 N O3 S -
Comments: Khan, Muneeb Hayat; Khan, Islam Ullah; Arshad, Muhammad Nadeem; Mughal, Shumaila Younas; Akkurt, Mehmet <i>N</i>-Cyclohexyl-4-methoxybenzenesulfonamide Acta Crystallographica Section E 67(4) (2011) o885-o886
Space group: A b a 2
Cell volume: 2796.9
Cell parameters: 17.2644; 20.4707; 7.9139; 90; 90; 90;  

COD ID: 2231357
CIF file

HKL data

Original IUCr paper

 Formula: - C36 H34 B N3 O -
Comments: Dong, Zhi-Yun; Yang, Yu; Gao, Guo-Hua 1-(2-Ureidoethyl)quinolinium tetraphenylborate Acta Crystallographica Section E 67(8) (2011) o2031
Space group: A b a 2
Cell volume: 5801.4
Cell parameters: 25.5434; 18.7954; 12.0837; 90; 90; 90;  

COD ID: 2231446
CIF file

HKL data

Original IUCr paper

 Formula: - C16 H14 Cl2 N4 -
Comments: Rivera, Augusto; Maldonado, Mauricio; Ríos-Motta, Jaime; Fejfarová, Karla; Dušek, Michal 2,9-Dichloro-6<i>H</i>,13<i>H</i>-5:12,7:14-dimethanodibenzo[<i>d</i>,<i>i</i>][1,3,6,8]tetraazecine Acta Crystallographica Section E 67(9) (2011) o2395
Space group: A b a 2
Cell volume: 1441
Cell parameters: 9.8633; 19.0429; 7.672; 90; 90; 90;  

COD ID: 2231649
CIF file

HKL data

Original IUCr paper

 Formula: - C17 H22 N2 O4 S2 -
Comments: Khan, Islam Ullah; Sheikh, Tahir Ali; Ejaz; Harrison, William T. A. <i>N</i>,<i>N</i>'-(Propane-1,3-diyl)bis(<i>p</i>-toluenesulfonamide) Acta Crystallographica Section E 67(9) (2011) o2371
Space group: A b a 2
Cell volume: 1866.4
Cell parameters: 12.3169; 18.0787; 8.3819; 90; 90; 90;  

COD ID: 2233181
CIF file

HKL data

Original IUCr paper

 Formula: - C15 H14 N4 O3 -
Comments: Bikas, Rahman; Anarjan, Parisa Mahboubi; Ng, Seik Weng; Tiekink, Edward R. T. 2-[((<i>E</i>)-2-{2-[(<i>E</i>)-2-Hydroxybenzylidene]hydrazinecarbonyl}hydrazinylidene)methyl]phenol Acta Crystallographica Section E 68(1) (2012) o193
Space group: A b a 2
Cell volume: 1375.84
Cell parameters: 14.3101; 9.362; 10.2697; 90; 90; 90;  

COD ID: 2233516
CIF file

HKL data

Original IUCr paper

 Formula: - C9 H6 I2 N2 -
Comments: Chlupatý, Tomáš; Pařík, Patrik; Padělková, Zdeňka 4,5-Diiodo-2-phenyl-1<i>H</i>-imidazole Acta Crystallographica Section E 68(2) (2012) o553-o554
Space group: A b a 2
Cell volume: 4367.4
Cell parameters: 31.015; 17.501; 8.0461; 90; 90; 90;  

COD ID: 2234250
CIF file

HKL data

Original IUCr paper

 Formula: - C36 H16 Br4 N4 Ni S4 -
Comments: Prasath, R.; Bhavana, P.; Ng, Seik Weng; Tiekink, Edward R. T. [<i>meso</i>-5,10,15,20-Tetrakis(5-bromothiophen-2-yl)porphyrinato-κ^4^<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''']nickel(II) Acta Crystallographica Section E 68(4) (2012) m471-m472
Space group: A b a 2
Cell volume: 6744.6
Cell parameters: 21.9367; 19.009; 16.1742; 90; 90; 90;  

COD ID: 2236696
CIF file

HKL data

Original IUCr paper

 Formula: - Ca H2 O8 Si2 Zn2 -
Comments: Yang, Hexiong; Jenkins, Neil G.; Downs, Robert T. Redetermination of junitoite, CaZn~2~Si~2~O~7~·H~2~O Acta Crystallographica Section E 68(10) (2012) i73-i73
Space group: A b a 2
Cell volume: 676.5
Cell parameters: 12.53; 6.3056; 8.562; 90; 90; 90;  

COD ID: 2237143
CIF file

HKL data

Original IUCr paper

 Formula: - C20 H20 N2 O2 -
Comments: Novina, J. Josephine; Vasuki, G.; Muthukumar, C.; Sabastiyan, A.; Crochet, A.; Fromm, K. M. 7-[(Morpholin-4-yl)(phenyl)methyl]quinolin-8-ol Acta Crystallographica Section E 69(1) (2013) o45
Space group: A b a 2
Cell volume: 3401.2
Cell parameters: 13.1537; 31.0875; 8.3175; 90; 90; 90;  

COD ID: 2238283
CIF file

HKL data

Original IUCr paper

 Formula: - C22 H54 Cl N O4 S Sn2 -
Comments: Diop, Tidiane; van der Lee, Arie; Sidibé, Mamadou Poly[tetrabutylammonium [chloridohexamethyl-μ~3~-sulfato-distannate(IV)]] Acta Crystallographica Section E 69(7) (2013) m406-m407
Space group: A b a 2
Cell volume: 6357.8
Cell parameters: 27.2051; 20.4336; 11.437; 90; 90; 90;  

COD ID: 2239755
CIF file

HKL data

 Formula: - C16 H8 Cl4 O2 -
Comments: Tittal, Ram K.; Kumar, Satish; Ram, R. N. (<i>Z</i>)-2,3-Dichloro-1,4-bis(4-chlorophenyl)but-2-ene-1,4-dione Acta Crystallographica Section E 70(8) (2014) o861-o862
Space group: A b a 2
Cell volume: 6493.1
Cell parameters: 19.065; 28.668; 11.88; 90; 90; 90;  

COD ID: 2310221
CIF file Formula: - Ni10 Zr7 -
Comments: Kirkpatrick, M.E.; Smith, J.F.; Larsen, W.L. Structures of the intermediate phases Ni10 Zr7 and Ni10 Hf7 Acta Crystallographica (1,1948-23,1967) 15 (1962) 894-903
Space group: A b a 2
Cell volume: 1044.58
Cell parameters: 9.211; 9.156; 12.386; 90; 90; 90;  

COD ID: 2310565
CIF file Formula: - F7 I -
Comments: Donohue, J. Concerning the evidence for the molecular symmetry of I F7 Acta Crystallographica (1,1948-23,1967) 18 (1965) 1018-1021
Space group: A b a 2
Cell volume: 475.996
Cell parameters: 8.74; 8.87; 6.14; 90; 90; 90;  

COD ID: 4021571
CIF file Formula: - C12 H22 O -
Comments: Kai Deng; Ahlem Bensari-Bouguerra; Joseph Whetstone; Theodore Cohen Cyclization by Intramolecular Carbolithiation of Alkyl- and Vinyllithiums Prepared by the Action of Aromatic Radical Anions on Phenyl Thioethers. High Stereoselectivity in the Cyclization Accelerated by an Allylic Lithium Oxyanion Journal of Organic Chemistry 71 (2006) 2360-2372
Space group: A b a 2
Cell volume: 4612.5
Cell parameters: 9.139; 19.074; 26.46; 90; 90; 90;  

COD ID: 4021871
CIF file Formula: - C19 H17 N O2 -
Comments: Yan-Chao Wu; Li Liu; Hui-Jing Li; Dong Wang; Yong-Jun Chen Skraup-Doebner-Von Miller Quinoline Synthesis Revisited: Reversal of the Regiochemistry for γ-Aryl-β,γ-unsaturated α-Ketoesters Journal of Organic Chemistry 71 (2006) 6592-6595
Space group: A b a 2
Cell volume: 3010.2
Cell parameters: 19.877; 18.927; 8.0012; 90; 90; 90;  

COD ID: 4025601
CIF file Formula: - C34 H40 D18 N8 O5 S3 -
Comments: Kinkini Roy; Chun Wang; Mark D. Smith; Perry J. Pellechia; Linda S. Shimizu Alkali Metal Ions As Probes of Structure and Recognition Properties of Macrocyclic Pyridyl Urea Hosts Journal of Organic Chemistry 75 (2010) 5453-5460
Space group: A b a 2
Cell volume: 7891.8
Cell parameters: 25.3621; 16.7341; 18.5947; 90; 90; 90;  

COD ID: 4025668
CIF file Formula: - C30 H32 N2 S -
Comments: Motonori Watanabe; Kenta Goto; Masahiko Shibahara; Teruo Shinmyozu Synthesis, Structure, and Electronic and Photophysical Properties of Two- and Three-Layered [3.3]Paracyclophane-Based Donor-Acceptor Systems(1) Journal of Organic Chemistry 75 (2010) 6104-6114
Space group: A b a 2
Cell volume: 4722.1
Cell parameters: 21.208; 16.936; 13.147; 90; 90; 90;  

COD ID: 4028383
CIF file Formula: - C30 H32 N4 O3 -
Comments: Shokoofeh Maghari; Sorour Ramezanpour; Saeed Balalaie; Fatemeh Darvish; Frank Rominger; Hamid Reza Bijanzadeh Synthesis of Functionalized Pseudopeptides through Five-Component Sequential Ugi/Nucleophilic Reaction of N-Substituted 2-Alkynamides with Hydrazides Journal of Organic Chemistry 78 (2013) 6450-6456
Space group: A b a 2
Cell volume: 5479.1
Cell parameters: 17.2631; 35.327; 8.9843; 90; 90; 90;  

COD ID: 4028507
CIF file Formula: - C23 H19 N -
Comments: Keith Ramig; Edyta M. Greer; David J. Szalda; Sasan Karimi; Allen Ko; Laura Boulos; Jiansan Gu; Nathan Dvorkin; Hema Bhramdat; Gopal Subramaniam NMR Spectroscopic and Computational Study of Conformational Isomerism in Substituted 2-Aryl-3H-1-benzazepines: Toward Isolable Atropisomeric Benzazepine Enantiomers Journal of Organic Chemistry 78 (2013) 8028-8036
Space group: A b a 2
Cell volume: 3389.56
Cell parameters: 13.2591; 25.5247; 10.0154; 90; 90; 90;  

COD ID: 4060562
CIF file Formula: - C24 H26 -
Comments: Rowshan Ara Begum; Paul R. Sharp Nickel and Platinum 1,2-Dibromoacenaphthylene Chemistry Organometallics (2005)
Space group: A b a 2
Cell volume: 3569
Cell parameters: 18.2792; 22.9191; 8.519; 90; 90; 90;  

COD ID: 4063812
CIF file Formula: - C29 H33 Cl2 N3 Ru -
Comments: Wieder, Noah L.; Carroll, Patrick J.; Berry, Donald H. Structure and Reactivity of Acetylene Complexes of Bis(imino)pyridine Ruthenium(0) Organometallics 30(8) (2011) 2125
Space group: A b a 2
Cell volume: 6513
Cell parameters: 16.979; 17.446; 21.989; 90; 90; 90;  

COD ID: 4065171
CIF file Formula: - C37 H34 F12 Fe2 N2 P2 -
Comments: Coe, Benjamin J.; Fielden, John; Foxon, Simon P.; Asselberghs, Inge; Clays, Koen; Van Cleuvenbergen, Stijn; Brunschwig, Bruce S. Ferrocenyl Diquat Derivatives: Nonlinear Optical Activity, Multiple Redox States, and Unusual Reactivity Organometallics 30(21) (2011) 5731
Space group: A b a 2
Cell volume: 3487.5
Cell parameters: 17.1942; 20.923; 9.6941; 90; 90; 90;  

COD ID: 4065548
CIF file Formula: - C37 H52 N2 O Ru -
Comments: Nun, Pierrick; Fortman, George C.; Slawin, Alexandra M. Z.; Nolan, Steven P. Ruthenium Hydroxide Complexes in the Racemization of Secondary Alcohols Organometallics 30(23) (2011) 6347
Space group: A b a 2
Cell volume: 6798
Cell parameters: 23.55; 17.464; 16.528; 90; 90; 90;  

COD ID: 4068663
CIF file Formula: - C24 H29 Cl O3 P2 Pd -
Comments: Hamada, Adel; Braunstein, Pierre Palladium Alkyl Complexes Containing β-Phosphonato−Phosphine P,O Ligands and Their Reactivity toward CO-Ethylene or -Acrylate Insertion Organometallics 28(6) (2009) 1688
Space group: A b a 2
Cell volume: 5110.3
Cell parameters: 32.473; 17.736; 8.873; 90; 90; 90;  

COD ID: 4069502
CIF file Formula: - C52 H72 Cu4 N4 O4 -
Comments: Oguadinma, Paul O.; Schaper, Frank Bis(2-phenylethyl)-nacnac: A Chiral Diketiminate Ligand and Its Copper Complexes Organometallics 28(14) (2009) 4089
Space group: A b a 2
Cell volume: 5346.2
Cell parameters: 24.418; 23.1746; 9.4477; 90; 90; 90;  

COD ID: 4076946
CIF file Formula: - C24 H45 B3 O6 -
Comments: Ali, Hijazi Abu; El Aziz Al Quntar, Abed; Goldberg, Israel; Srebnik, Morris Platinum(0)-Catalyzed Diboration of Alkynylboronates and Alkynylphosphonates with Bis(pinacolato)diborane(4): Molecular Structures of [((Me4C2O2)B)(C6H5)CC(P(O)(OC2H5)2)(B(O2C2Me4))] and [((Me4C2O2)B)(C4H9)CC(B(O2C2Me4))2] Organometallics 21(21) (2002) 4533
Space group: A b a 2
Cell volume: 2805.9
Cell parameters: 12.421; 12.603; 17.924; 90; 90; 90;  

COD ID: 4077751
CIF file Formula: - C56 H77 Cl2 Gd4 N5 O3 Si4 -
Comments: Xie, Zuowei; Wang, Shaowu; Yang, Qingchuan; Mak, Thomas C. W. Synthesis and Structure of the First Tetranuclear Organolanthanide Cluster Containing aμ4-Imido Group Organometallics 18(9) (1999) 1578
Space group: A b a 2
Cell volume: 6288.4
Cell parameters: 21.625; 19.226; 15.125; 90; 90; 90;  

COD ID: 4077752
CIF file Formula: - C56 H77 Cl2 Er4 N5 O3 Si4 -
Comments: Xie, Zuowei; Wang, Shaowu; Yang, Qingchuan; Mak, Thomas C. W. Synthesis and Structure of the First Tetranuclear Organolanthanide Cluster Containing aμ4-Imido Group Organometallics 18(9) (1999) 1578
Space group: A b a 2
Cell volume: 6210.9
Cell parameters: 21.528; 19.101; 15.104; 90; 90; 90;  

COD ID: 4079875
CIF file Formula: - C8 H10 Ag3 N4 O6 -
Comments: Hu, Ting; Mak, Thomas C. W. Silver(I) Double and Multiple Salts Containing 1,5-Hexadiyne-1,6-diide and Nitrate Ions Organometallics 32(1) (2013) 202
Space group: A b a 2
Cell volume: 2780.7
Cell parameters: 8.2733; 14.2973; 23.5083; 90; 90; 90;  

COD ID: 4080623
CIF file Formula: - C23 H28 N4 -
Comments: Chen, Wen-Ching; Hsu, Yu-Chen; Lee, Ching-Yu; Yap, Glenn P. A.; Ong, Tiow-Gan Synthetic Modification of Acyclic Bent Allenes (Carbodicarbenes) and Further Studies on Their Structural Implications and Reactivities Organometallics 32(8) (2013) 2435
Space group: A b a 2
Cell volume: 1955.35
Cell parameters: 15.1461; 16.6023; 7.776; 90; 90; 90;  

COD ID: 4081101
CIF file Formula: - C12 H18.5 Co0.5 I N O2.5 -
Comments: Hosokawa, Satomi; Ito, Jun-ichi; Nishiyama, Hisao NCN-Pincer Cobalt Complexes Containing Bis(oxazolinyl)phenyl Ligands Organometallics 32(14) (2013) 3980
Space group: A b a 2
Cell volume: 2864.4
Cell parameters: 8.975; 17.704; 18.027; 90; 90; 90;  

COD ID: 4083268
CIF file Formula: - C50 H53 B Cl Ir N4 -
Comments: Gray, Katherine; Page, Michael J.; Wagler, Jörg; Messerle, Barbara A. Iridium(III) Cp* Complexes for the Efficient Hydroamination of Internal Alkynes Organometallics 31(17) (2012) 6270
Space group: A b a 2
Cell volume: 8774.34
Cell parameters: 19.6897; 25.1941; 17.6879; 90; 90; 90;  

COD ID: 4083272
CIF file Formula: - C50 H53 B Cl N4 Rh -
Comments: Gray, Katherine; Page, Michael J.; Wagler, Jörg; Messerle, Barbara A. Iridium(III) Cp* Complexes for the Efficient Hydroamination of Internal Alkynes Organometallics 31(17) (2012) 6270
Space group: A b a 2
Cell volume: 8741
Cell parameters: 19.6719; 25.202; 17.6312; 90; 90; 90;  

COD ID: 4086033
CIF file Formula: - C12 Fe O12 Ru2 -
Comments: Farrugia, L.J.; Grepioni, F.; Gillon, A.L.; Braga, D. Dynamic disorder and fluxionality in M3 (C O)12 clusters: variable-temperature X-ray diffraction studies on Fen Ru3-n (C O)12 (n = 1,2) and the low-temperature phase of Fe3 (C O)12 Organometallics 18 (1999) 5022-5033
Space group: A b a 2
Cell volume: 3391.66
Cell parameters: 22.639; 12.8789; 11.6326; 90; 90; 90;  

COD ID: 4100318
CIF file Formula: - C44 H103 Cl12 Fe10 N15 -
Comments: Journal of the American Chemical Society (2005)
Space group: A b a 2
Cell volume: 15417
Cell parameters: 43.523; 23.303; 15.201; 90; 90; 90;  

COD ID: 4101011
CIF file Formula: - C23 H14 Cr N2 O9 -
Comments: Journal of the American Chemical Society (2006)
Space group: A b a 2
Cell volume: 4643
Cell parameters: 24.13; 12.02; 16.008; 90; 90; 90;  

COD ID: 4102736
CIF file Formula: - C53 H54 N4 O8 S2 -
Comments: Benjamin J. Coe; John Fielden; Simon P. Foxon; James A. Harris; Madeleine Helliwell; Bruce S. Brunschwig; Inge Asselberghs; Koen Clays; Javier Garín; Jesús Orduna Diquat Derivatives: Highly Active, Two-Dimensional Nonlinear Optical Chromophores with Potential Redox Switchability Journal of the American Chemical Society 132 (2010) 10498-10512
Space group: A b a 2
Cell volume: 4593
Cell parameters: 10.31; 35.917; 12.402; 90; 90; 90;  

COD ID: 4105011
CIF file Formula: - C66 H150 Fe8 N6 O3 S9 Si8 -
Comments: Yasuhiro Ohki; Motosuke Imada; Ayuro Murata; Yusuke Sunada; Shun Ohta; Masaru Honda; Takahiro Sasamori; Norihiro Tokitoh; Motomi Katada; Kazuyuki Tatsumi Synthesis, Structures, and Electronic Properties of [8Fe-7S] Cluster Complexes Modeling the Nitrogenase P-Cluster Journal of the American Chemical Society 131 (2009) 13168-13178
Space group: A b a 2
Cell volume: 19872
Cell parameters: 26.522; 28.749; 26.062; 90; 90; 90;  

COD ID: 4105013
CIF file Formula: - C62 H140 Cl2 Fe8 N6 O2.5 S9 Si8 -
Comments: Yasuhiro Ohki; Motosuke Imada; Ayuro Murata; Yusuke Sunada; Shun Ohta; Masaru Honda; Takahiro Sasamori; Norihiro Tokitoh; Motomi Katada; Kazuyuki Tatsumi Synthesis, Structures, and Electronic Properties of [8Fe-7S] Cluster Complexes Modeling the Nitrogenase P-Cluster Journal of the American Chemical Society 131 (2009) 13168-13178
Space group: A b a 2
Cell volume: 20164
Cell parameters: 26.503; 29.012; 26.224; 90; 90; 90;  

COD ID: 4105014
CIF file Formula: - C64 H144 Br2 Fe8 N6 O3 S9 Si8 -
Comments: Yasuhiro Ohki; Motosuke Imada; Ayuro Murata; Yusuke Sunada; Shun Ohta; Masaru Honda; Takahiro Sasamori; Norihiro Tokitoh; Motomi Katada; Kazuyuki Tatsumi Synthesis, Structures, and Electronic Properties of [8Fe-7S] Cluster Complexes Modeling the Nitrogenase P-Cluster Journal of the American Chemical Society 131 (2009) 13168-13178
Space group: A b a 2
Cell volume: 20097
Cell parameters: 26.201; 28.989; 26.46; 90; 90; 90;  

COD ID: 4105838
CIF file Formula: - Ga Pr4 S9 Sb -
Comments: Mei-Chun Chen; Long-Hua Li; Yu-Biao Chen; Ling Chen In-Phase Alignments of Asymmetric Building Units in Ln4GaSbS9 (Ln = Pr, Nd, Sm, Gd-Ho) and Their Strong Nonlinear Optical Responses in Middle IR Journal of the American Chemical Society 133 (2011) 4617-4624
Space group: A b a 2
Cell volume: 2804
Cell parameters: 13.799; 14.187; 14.323; 90; 90; 90;  

COD ID: 4105839
CIF file Formula: - Ga Nd4 S9 Sb -
Comments: Mei-Chun Chen; Long-Hua Li; Yu-Biao Chen; Ling Chen In-Phase Alignments of Asymmetric Building Units in Ln4GaSbS9 (Ln = Pr, Nd, Sm, Gd-Ho) and Their Strong Nonlinear Optical Responses in Middle IR Journal of the American Chemical Society 133 (2011) 4617-4624
Space group: A b a 2
Cell volume: 2776.8
Cell parameters: 13.759; 14.113; 14.3; 90; 90; 90;  

COD ID: 4105840
CIF file Formula: - Ga S9 Sb Sm4 -
Comments: Mei-Chun Chen; Long-Hua Li; Yu-Biao Chen; Ling Chen In-Phase Alignments of Asymmetric Building Units in Ln4GaSbS9 (Ln = Pr, Nd, Sm, Gd-Ho) and Their Strong Nonlinear Optical Responses in Middle IR Journal of the American Chemical Society 133 (2011) 4617-4624
Space group: A b a 2
Cell volume: 2701.9
Cell parameters: 13.64; 13.983; 14.166; 90; 90; 90;  

COD ID: 4105841
CIF file Formula: - Ga Gd4 S9 Sb -
Comments: Mei-Chun Chen; Long-Hua Li; Yu-Biao Chen; Ling Chen In-Phase Alignments of Asymmetric Building Units in Ln4GaSbS9 (Ln = Pr, Nd, Sm, Gd-Ho) and Their Strong Nonlinear Optical Responses in Middle IR Journal of the American Chemical Society 133 (2011) 4617-4624
Space group: A b a 2
Cell volume: 2659
Cell parameters: 13.5733; 13.8956; 14.0982; 90; 90; 90;  

COD ID: 4105842
CIF file Formula: - Ga S9 Sb Tb4 -
Comments: Mei-Chun Chen; Long-Hua Li; Yu-Biao Chen; Ling Chen In-Phase Alignments of Asymmetric Building Units in Ln4GaSbS9 (Ln = Pr, Nd, Sm, Gd-Ho) and Their Strong Nonlinear Optical Responses in Middle IR Journal of the American Chemical Society 133 (2011) 4617-4624
Space group: A b a 2
Cell volume: 2632.8
Cell parameters: 13.53; 13.85; 14.05; 90; 90; 90;  

COD ID: 4105843
CIF file Formula: - Dy4 Ga S9 Sb -
Comments: Mei-Chun Chen; Long-Hua Li; Yu-Biao Chen; Ling Chen In-Phase Alignments of Asymmetric Building Units in Ln4GaSbS9 (Ln = Pr, Nd, Sm, Gd-Ho) and Their Strong Nonlinear Optical Responses in Middle IR Journal of the American Chemical Society 133 (2011) 4617-4624
Space group: A b a 2
Cell volume: 2607.6
Cell parameters: 13.4762; 13.8105; 14.0109; 90; 90; 90;  

COD ID: 4105844
CIF file Formula: - Ga Ho4 S9 Sb -
Comments: Mei-Chun Chen; Long-Hua Li; Yu-Biao Chen; Ling Chen In-Phase Alignments of Asymmetric Building Units in Ln4GaSbS9 (Ln = Pr, Nd, Sm, Gd-Ho) and Their Strong Nonlinear Optical Responses in Middle IR Journal of the American Chemical Society 133 (2011) 4617-4624
Space group: A b a 2
Cell volume: 2577.3
Cell parameters: 13.427; 13.756; 13.954; 90; 90; 90;  

COD ID: 4110858
CIF file Formula: - C92 H164 B4 Fe12 Mo4 N37 S20 -
Comments: Curtis P. Berlinguette; R. H. Holm Edge-Bridged Mo2Fe6S8 to PN-Type Mo2Fe6S9 Cluster Conversion: Structural Fate of the Attacking Sulfide/Selenide Nucleophile Journal of the American Chemical Society 128 (2006) 11993-12000
Space group: A b a 2
Cell volume: 15454
Cell parameters: 36.478; 26.208; 16.165; 90; 90; 90;  

COD ID: 4113599
CIF file Formula: - C46 H82 B2 Fe6 Mo2 N18.5 S7 Se3 -
Comments: Yugen Zhang; R. H. Holm Synthesis of a Molecular Mo2Fe6S9 Cluster with the Topology of the PN Cluster of Nitrogenase by Rearrangement of an Edge-Bridged Mo2Fe6S8 Double Cubane Journal of the American Chemical Society 125 (2003) 3910-3920
Space group: A b a 2
Cell volume: 15630
Cell parameters: 36.883; 26.168; 16.194; 90; 90; 90;  

COD ID: 4114009
CIF file Formula: - Ge2 Hg3 K2 S8 -
Comments: J.-H. Liao; G. M. Marking; K. F. Hsu; Y. Matsushita; M. D. Ewbank; R. Borwick; P. Cunningham; M. J. Rosker; M. G. Kanatzidis α- and β-A2Hg3M2S8 (A = K, Rb; M = Ge, Sn): Polar Quaternary Chalcogenides with Strong Nonlinear Optical Response Journal of the American Chemical Society 125 (2003) 9484-9493
Space group: A b a 2
Cell volume: 1510.3
Cell parameters: 19.082; 9.551; 8.2871; 90; 90; 90;  

COD ID: 4114010
CIF file Formula: - Hg3 K2 S8 Sn2 -
Comments: J.-H. Liao; G. M. Marking; K. F. Hsu; Y. Matsushita; M. D. Ewbank; R. Borwick; P. Cunningham; M. J. Rosker; M. G. Kanatzidis α- and β-A2Hg3M2S8 (A = K, Rb; M = Ge, Sn): Polar Quaternary Chalcogenides with Strong Nonlinear Optical Response Journal of the American Chemical Society 125 (2003) 9484-9493
Space group: A b a 2
Cell volume: 1632
Cell parameters: 19.5634; 9.8527; 8.4667; 90; 90; 90;  

COD ID: 4114672
CIF file Formula: - C29 H38 Cu F12 N5 O5 P2 -
Comments: Shin-ichiro Noro; Ryo Kitaura; Mitsuru Kondo; Susumu Kitagawa; Tomohiko Ishii; Hiroyuki Matsuzaka; Masahiro Yamashita Framework Engineering by Anions and Porous Functionalities of Cu(II)/4,4'-bpy Coordination Polymers Journal of the American Chemical Society 124 (2002) 2568-2583
Space group: A b a 2
Cell volume: 7679
Cell parameters: 45.47; 20.523; 8.229; 90; 90; 90;  

COD ID: 4114673
CIF file Formula: - C29 H38 Cl Cu F6 N5 O9 P -
Comments: Shin-ichiro Noro; Ryo Kitaura; Mitsuru Kondo; Susumu Kitagawa; Tomohiko Ishii; Hiroyuki Matsuzaka; Masahiro Yamashita Framework Engineering by Anions and Porous Functionalities of Cu(II)/4,4'-bpy Coordination Polymers Journal of the American Chemical Society 124 (2002) 2568-2583
Space group: A b a 2
Cell volume: 7439
Cell parameters: 44.87; 20.292; 8.17; 90; 90; 90;  

COD ID: 4115433
CIF file Formula: - C16 H41 Ge N Si4 -
Comments: Karla A. Miller; Thomas W. Watson; John E. Bender; Mark M. Banaszak Holl; Jeff W. Kampf Intermolecular C-H Insertions and Cyclization Reactions Involving a Stable Germylene Journal of the American Chemical Society 123 (2001) 982-983
Space group: A b a 2
Cell volume: 2503.06
Cell parameters: 14.2877; 21.2552; 8.2422; 90; 90; 90;  

COD ID: 4116818
CIF file Formula: - C46 H88 Cl4 N10 O12 -
Comments: Anton W. Bosman; Monique J. Bruining; Huub Kooijman; Anthony L. Spek; René A. J. Janssen; E. W. Meijer Concerning the Localization of End Groups in Dendrimers Journal of the American Chemical Society 120 (1998) 8547-8548
Space group: A b a 2
Cell volume: 6099
Cell parameters: 22.942; 24.674; 10.775; 90; 90; 90;  

COD ID: 4121603
CIF file Formula: - C28 H20 Co N2 O4 -
Comments: Elsaidi, Sameh K.; Mohamed, Mona H.; Wojtas, Lukasz; Chanthapally, Anjana; Pham, Tony; Space, Brian; Vittal, Jagadese J.; Zaworotko, Michael J. Putting the Squeeze on CH4 and CO2 through Control over Interpenetration in Diamondoid Nets. Journal of the American Chemical Society 136(13) (2014) 5072-5077
Space group: A b a 2
Cell volume: 2482
Cell parameters: 13.1543; 21.7445; 8.6774; 90; 90; 90;  

COD ID: 4122326
CIF file Formula: - C304 H320 Au16 N16 O16 S32 -
Comments: Jiang, Xuan-Feng; Hau, Franky Ka-Wah; Sun, Qing-Fu; Yu, Shu-Yan; Yam, Vivian Wing-Wah From {au(i)···au(i)}-coupled cages to the cage-built 2-d {au(i)···au(i)} arrays: au(i)···au(i) bonding interaction driven self-assembly and their ag(i) sensing and photo-switchable behavior. Journal of the American Chemical Society 136(31) (2014) 10921-10929
Space group: A b a 2
Cell volume: 32350
Cell parameters: 36.036; 21.732; 41.308; 90; 90; 90;  

COD ID: 4305301
CIF file Formula: - C52 H90 F24 N12 Ni6 O25 -
Comments: Z. Tomkowicz; S. Ostrovsky; H. Müller-Bunz; A. J. Hussein Eltmimi; M. Rams; D. A. Brown; W. Haase Extended Triple-Bridged Ni(II)- and Co(II)-Hydroxamate Trinuclear Complexes: Synthesis, Crystal Structures, and Magnetic Properties Inorganic Chemistry 47 (2008) 6956-6963
Space group: A b a 2
Cell volume: 8849
Cell parameters: 16.0444; 36.222; 15.2264; 90; 90; 90;  

COD ID: 4306458
CIF file Formula: - C29 H71 Li3 O5 Y2 -
Comments: Mathias U. Kramer; Dominique Robert; Stefan Arndt; Peter M. Zeimentz; Thomas P. Spaniol; Ahmed Yahia; Laurent Maron; Odile Eisenstein; Jun Okuda Cationic Methyl Complexes of the Rare-Earth Metals: An Experimental and Computational Study on Synthesis, Structure, and Reactivity Inorganic Chemistry 47 (2008) 9265-9278
Space group: A b a 2
Cell volume: 4167.1
Cell parameters: 15.681; 16.058; 16.549; 90; 90; 90;  

COD ID: 4306459
CIF file Formula: - C29 H71 Li3 O5 Tb2 -
Comments: Mathias U. Kramer; Dominique Robert; Stefan Arndt; Peter M. Zeimentz; Thomas P. Spaniol; Ahmed Yahia; Laurent Maron; Odile Eisenstein; Jun Okuda Cationic Methyl Complexes of the Rare-Earth Metals: An Experimental and Computational Study on Synthesis, Structure, and Reactivity Inorganic Chemistry 47 (2008) 9265-9278
Space group: A b a 2
Cell volume: 4184.7
Cell parameters: 16.447; 16.171; 15.734; 90; 90; 90;  

COD ID: 4308706
CIF file Formula: - C24 H29 Cl O3 P2 Pt -
Comments: Nicola Oberbeckmann-Winter; Xavier Morise; Pierre Braunstein; Richard Welter Synthesis and Structure of Pt(II) Phosphonato-Phosphine Complexes and of a P,O-Stabilized Metal-Metal-Bonded Pt2Ag2 Complex Inorganic Chemistry 44 (2005) 1391-1403
Space group: A b a 2
Cell volume: 5095.6
Cell parameters: 32.453; 17.774; 8.834; 90; 90; 90;  

COD ID: 4308717
CIF file Formula: - C56 H48 B F24 N2 P Pt -
Comments: Raffaello Romeo; Salvatore Carnabuci; Maria Rosaria Plutino; Andrea Romeo; Silvia Rizzato; Alberto Albinati Structural Properties and Dissociative Fluxional Motion of 2,9-Dimethyl-1,10-Phenanthroline in Platinum(II) Complexes Inorganic Chemistry 44 (2005) 1248-1262
Space group: A b a 2
Cell volume: 13524
Cell parameters: 39.5675; 17.7672; 19.237; 90; 90; 90;  

COD ID: 4310100
CIF file Formula: - C84 H124 Mn12 O48 -
Comments: Philippa King; Wolfgang Wernsdorfer; Khalil A. Abboud; George Christou Single-Molecule Magnets: A Reductive Aggregation Route to New Types of Mn12 Complexes Inorganic Chemistry 44 (2005) 8659-8669
Space group: A b a 2
Cell volume: 12157.1
Cell parameters: 21.2382; 29.477; 19.4191; 90; 90; 90;  

COD ID: 4312110
CIF file Formula: - C15 H26 Cl Cu N6 -
Comments: Sarah H. Oakley; Martyn P. Coles; Peter B. Hitchcock Multiple Coordination Geometries Supported by Methylene-Linked Guanidines Inorganic Chemistry 43 (2004) 7564-7566
Space group: A b a 2
Cell volume: 3356.9
Cell parameters: 14.1579; 14.7107; 16.1177; 90; 90; 90;  

COD ID: 4312406
CIF file Formula: - C33 H33 Mo8 N6 O40 P8 -
Comments: Nathalie Calin; Slavi C. Sevov Novel Mixed-Valence Heteropolyoxometalates: A Molybdenum Diphosphonate Anion [MoV7MoVIO16(O3PPhPO3H)4]3- and Its One- and Two-Dimensional Assemblies Inorganic Chemistry 42 (2003) 7304-7308
Space group: A b a 2
Cell volume: 7151.9
Cell parameters: 16.675; 17.238; 24.881; 90; 90; 90;  

COD ID: 4312502
CIF file Formula: - C65 H49 Cl3 F24 Fe2 N8 O -
Comments: Takashi Hayashi; Yuji Nakashima; Kazuyuki Ito; Takahiro Ikegami; Isao Aritome; Katsuhiro Aoyagi; Tsutomu Ando; Yoshio Hisaeda Synthesis, Characterization, and Autoreduction of a Highly Electron-Deficient Porphycenatoiron(III) with Trifluoromethyl Substituents Inorganic Chemistry 42 (2003) 7345-7347
Space group: A b a 2
Cell volume: 6618.1
Cell parameters: 14.568; 21.6097; 21.0226; 90; 90; 90;  

COD ID: 4312664
CIF file Formula: - C30 H26 Cu N4 -
Comments: Chizu Shimokawa; Seiji Yokota; Yoshimitsu Tachi; Nagatoshi Nishiwaki; Masahiro Ariga; Shinobu Itoh Substituent Effects of β-Diketiminate Ligands on the Structure and Physicochemical Properties of Copper(II) Complexes Inorganic Chemistry 42 (2003) 8395-8405
Space group: A b a 2
Cell volume: 2389
Cell parameters: 14.19; 7.087; 23.76; 90; 90; 90;  

COD ID: 4313593
CIF file Formula: - C53 H65 Fe N2 O3 P S2 -
Comments: Prasanta Ghosh; Ameerunisha Begum; Eckhard Bill; Thomas Weyhermüller; Karl Wieghardt Molecular and Electronic Structures of Iron(II)/(III) Complexes Containing N,S-Coordinated, Closed-Shello-Aminothiophenolato(1-) and o-Iminothiophenolato(2-) Ligands Inorganic Chemistry 42 (2003) 3208-3215
Space group: A b a 2
Cell volume: 4936.5
Cell parameters: 28.436; 17.4172; 9.9671; 90; 90; 90;  

COD ID: 4314532
CIF file Formula: - C127.5 H124.5 Co3 Cr2 N15.5 O4.5 P8 -
Comments: Carolina Avendano; Ferdi Karadas; Matthew Hilfiger; Michael Shatruk; Kim R. Dunbar Cyanide Lability and Linkage Isomerism of Hexacyanochromate(III) Induced by the Co(II) Ion Inorganic Chemistry 49 (2010) 583-594
Space group: A b a 2
Cell volume: 26600
Cell parameters: 51.547; 26.188; 19.705; 90; 90; 90;  

COD ID: 4314740
CIF file Formula: - C58 H72 N18 O20 Pd3 S2 -
Comments: Kazuhiro Uehara; Ko Kasai; Noritaka Mizuno Synthetic and Computational Studies on Factors Controlling Structures of Molecular Triangles and Squares and Their Equilibrium in Solutions Inorganic Chemistry 49 (2010) 2008-2015
Space group: A b a 2
Cell volume: 8757.5
Cell parameters: 14.6642; 27.8763; 21.4233; 90; 90; 90;  

COD ID: 4316550
CIF file Formula: - C5 H3 Co N9 O -
Comments: Oindrila Sengupta; Partha Sarathi Mukherjee Mixed Azide and 5-(Pyrimidyl)tetrazole Bridged Co(II)/Mn(II) Polymers: Synthesis, Crystal Structures, Ferroelectric and Magnetic Behavior Inorganic Chemistry 49 (2010) 8583-8590
Space group: A b a 2
Cell volume: 1798.7
Cell parameters: 11.0858; 22.4539; 7.2261; 90; 90; 90;  

COD ID: 4316775
CIF file Formula: - C16 H18 K4 N2 O11 P2 -
Comments: Sylvie Pailloux; Cornel Edicome Shirima; Karen Ann Smith; Eileen N. Duesler; Robert T. Paine; Neil J. Williams; Robert D. Hancock Synthesis and Reactivity of (Benzoxazol-2-ylmethyl)phosphonic Acid Inorganic Chemistry 49 (2010) 9369-9379
Space group: A b a 2
Cell volume: 2373.8
Cell parameters: 34.134; 9.7662; 7.1209; 90; 90; 90;  

COD ID: 4320645
CIF file Formula: - C132 H42 F80 Fe Mn12 O50 -
Comments: Takayoshi Kuroda-Sowa; Matthew Lam; Arnold L. Rheingold; Christoph Frommen; William M. Reiff; Motohiro Nakano; Jae Yoo; A. L. Maniero; Louis-Claude Brunel; George Christou; David N. Hendrickson Effects of Paramagnetic Ferrocenium Cations on the Magnetic Properties of the Anionic Single-Molecule Magnet [Mn12O12(O2CC6F5)16(H2O)4]- Inorganic Chemistry 40 (2001) 6469-6480
Space group: A b a 2
Cell volume: 19018.2
Cell parameters: 25.6292; 25.4201; 29.1915; 90; 90; 90;  

COD ID: 4326591
CIF file Formula: - C47 H38 Cl6 Fe4 N -
Comments: Alexander Hildebrandt; Dieter Schaarschmidt; Ron Claus; Heinrich Lang Influence of Electron Delocalization in Heterocyclic Core Systems on the Electrochemical Communication in 2,5-Di- and 2,3,4,5-Tetraferrocenyl Thiophenes, Furans, and Pyrroles Inorganic Chemistry 50 (2011) 10623-10632
Space group: A b a 2
Cell volume: 8458.9
Cell parameters: 17.6554; 41.9726; 11.4149; 90; 90; 90;  

COD ID: 4329048
CIF file Formula: - C43 H79.5 Fe2 Mn N8.5 O13 -
Comments: Galina M. Dulcevscaia; Irina G. Filippova; Manfred Speldrich; Jan van Leusen; Victor Ch. Kravtsov; Svetlana G. Baca; Paul Kögerler; Shi-Xia Liu; Silvio Decurtins Cluster-Based Networks: 1D and 2D Coordination Polymers Based on {MnFe~2~(μ~3~-O)}-Type Clusters Inorganic Chemistry 51 (2012) 5110-5117
Space group: A b a 2
Cell volume: 11139
Cell parameters: 23.127; 24.574; 19.6; 90; 90; 90;  

COD ID: 4332086
CIF file Formula: - Co2 In2 O26 Rb6 Si9 -
Comments: Hung, Ling-I; Wang, Sue-Lein; Chen, Yen-Hung; Lii, Kwang-Hwa Rb6(InCo)2(Si9O26): A Mixed-Metal Silicate Containing 20-Membered-Ring Silicate Single Layers with a Very Low Si:O Ratio Inorganic Chemistry 45(5) (2006) 2100-2103
Space group: A b a 2
Cell volume: 2708.1
Cell parameters: 20.7791; 12.0944; 10.7761; 90; 90; 90;  

COD ID: 4332207
CIF file Formula: - C78 H68 B Cl4 F4 N12 Ni2 -
Comments: Berry, John F.; Bothe, Eberhard; Cotton, F. Albert; Ibragimov, Sergey A.; Murillo, Carlos A.; Villagrán, Dino; Wang, Xiaoping Metal−Metal Bonding in Mixed Valence Ni25+Complexes and Spectroscopic Evidence for a Ni26+Species Inorganic Chemistry 45(11) (2006) 4396-4406
Space group: A b a 2
Cell volume: 7170
Cell parameters: 17.5916; 18.8152; 21.6622; 90; 90; 90;  

COD ID: 4333300
CIF file Formula: - C156 H206 As32 N46 O170 V54 Zn10 -
Comments: Zheng, Shou-Tian; Wang, Ming-Hui; Yang, Guo-Yu In situ ligand reactions under hydrothermal conditions afford a novel zinc-substituted polyoxovanadate dimer. Inorganic chemistry 46(22) (2007) 9503-9508
Space group: A b a 2
Cell volume: 32997
Cell parameters: 28.3414; 27.9995; 41.5819; 90; 90; 90;  

COD ID: 4333584
CIF file Formula: - C73 H133 Mn9 O35 -
Comments: Shreya Mukherjee; Khalil A. Abboud; Wolfgang Wernsdorfer; George Christou Comproportionation Reactions to Manganese(III/IV) Pivalate Clusters: A New Half-Integer Spin Single-Molecule Magnet Inorganic Chemistry 52 (2013) 873-884
Space group: A b a 2
Cell volume: 30516
Cell parameters: 20.555; 68.895; 21.549; 90; 90; 90;  

COD ID: 4334484
CIF file Formula: - C10 H27 Cl F6 N3 O2 P Ru S2 -
Comments: Aimee J. Gamble; Jason M. Lynam; Robert J. Thatcher; Paul H. Walton; Adrian C. Whitwood cis-1,3,5-Triaminocyclohexane as a Facially Capping Ligand for Ruthenium(II) Inorganic Chemistry 52 (2013) 4517-4527
Space group: A b a 2
Cell volume: 3947.5
Cell parameters: 14.7124; 15.6131; 17.1848; 90; 90; 90;  

COD ID: 4336625
CIF file Formula: - C78 H50 Ce N2 O18 -
Comments: Yan-Ping He; Yan-Xi Tan; Jian Zhang Gas Sorption, Second-Order Nonlinear Optics, and Luminescence Properties of a Series of Lanthanide-Organic Frameworks Based on Nanosized Tris((4-carboxyl)phenylduryl)amine Ligand Inorganic Chemistry 52 (2013) 12758-12762
Space group: A b a 2
Cell volume: 7678.5
Cell parameters: 35.7507; 16.3257; 13.1559; 90; 90; 90;  

COD ID: 4338270
CIF file Formula: - C132 H162 Co2 Fe4 N24 Ni3 O32 -
Comments: Lytvynenko, A. S.; Kolotilov, S. V.; Kiskin, M. A.; Cador, O.; Golhen, S.; Aleksandrov, G. G.; Mishura, A. M.; Titov, V. E.; Ouahab, L.; Eremenko, I. L.; Novotortsev, V. M. Redox-Active Porous Coordination Polymers Prepared by Trinuclear Heterometallic Pivalate Linking with the Redox-Active Nickel(II) Complex: Synthesis, Structure, Magnetic and Redox Properties, and Electrocatalytic Activity in Organic Compound Dehalogenation in Heterogeneous Medium. Inorganic chemistry 53(10) (2014) 4970-4979
Space group: A b a 2
Cell volume: 23920
Cell parameters: 35.593; 23.278; 28.87; 90; 90; 90;  

COD ID: 4343284
CIF file Formula: - C15 H12.5 Co N2.5 O6 -
Comments: Singha, Debal Kanti; Mahata, Partha Highly Selective and Sensitive Luminescence Turn-On-Based Sensing of Al(3+) Ions in Aqueous Medium Using a MOF with Free Functional Sites. Inorganic chemistry 54(13) (2015) 6373-6379
Space group: A b a 2
Cell volume: 3018.08
Cell parameters: 14.028; 29.3136; 7.3395; 90; 90; 90;  

COD ID: 4501048
CIF file Formula: - C11 H12 O3 -
Comments: Mehta, Goverdhan; Sen, Saikat Interesting Modes of Self-assembly of Achiral 12-Oxo-11,13-dioxa[4.4.3]propellanes in a Noncentrosymmetric Environment Crystal Growth & Design 11(9) (2011) 3721
Space group: A b a 2
Cell volume: 936.7
Cell parameters: 11.512; 11.456; 7.1028; 90; 90; 90;  

COD ID: 4502480
CIF file Formula: - C12 H11 Ag N4 O4 -
Comments: Kundu, Nabanita; Audhya, Anandalok; Abtab, Sk Md Towsif; Ghosh, Sanjib; Tiekink, Edward R. T.; Chaudhury, Muktimoy Anion-Controlled Assembly of Silver(I) Complexes of Multiring Heterocyclic Ligands: A Structural and Photophysical Study Crystal Growth & Design 10(3) (2010) 1269
Space group: A b a 2
Cell volume: 2563.4
Cell parameters: 18.0934; 12.9305; 10.9566; 90; 90; 90;  

COD ID: 4503852
CIF file Formula: - C22 H18 F2 N2 O2 -
Comments: Kato, Takako; Okamoto, Iwao; Masu, Hyuma; Katagiri, Kosuke; Tominaga, Masahide; Yamaguchi, Kentaro; Kagechika, Hiroyuki; Azumaya, Isao Polymorphism and Pseudopolymorphism of an Aromatic Amide: Spontaneous Resolution and Crystal-to-Crystal phase Transition Crystal Growth & Design 8(10) (2008) 3871
Space group: A b a 2
Cell volume: 1932
Cell parameters: 13.82; 15.563; 8.985; 90; 90; 90;  

COD ID: 4503853
CIF file Formula: - C22 H18 F2 N2 O2 -
Comments: Kato, Takako; Okamoto, Iwao; Masu, Hyuma; Katagiri, Kosuke; Tominaga, Masahide; Yamaguchi, Kentaro; Kagechika, Hiroyuki; Azumaya, Isao Polymorphism and Pseudopolymorphism of an Aromatic Amide: Spontaneous Resolution and Crystal-to-Crystal phase Transition Crystal Growth & Design 8(10) (2008) 3871
Space group: A b a 2
Cell volume: 1791.2
Cell parameters: 17.8296; 7.4296; 13.5221; 90; 90; 90;  

COD ID: 4503855
CIF file Formula: - C22.5 H19 Cl F2 N2 O2 -
Comments: Kato, Takako; Okamoto, Iwao; Masu, Hyuma; Katagiri, Kosuke; Tominaga, Masahide; Yamaguchi, Kentaro; Kagechika, Hiroyuki; Azumaya, Isao Polymorphism and Pseudopolymorphism of an Aromatic Amide: Spontaneous Resolution and Crystal-to-Crystal phase Transition Crystal Growth & Design 8(10) (2008) 3871
Space group: A b a 2
Cell volume: 3963.1
Cell parameters: 28.459; 8.9853; 15.4982; 90; 90; 90;  

COD ID: 4504229
CIF file Formula: - C12 H11 Ag N4 O4 -
Comments: Li, Xiang-Ping; Pan, Mei; Zheng, Sheng-Run; Liu, Yong-Ru; He, Qi-Ting; Kang, Bei-Sheng; Su, Cheng-Yong Dimension Increase via Hydrogen Bonding and Weak Coordination Interactions from Simple Complexes of 2-(Pyridyl)benzimidazole Ligands Crystal Growth & Design 7(12) (2007) 2481
Space group: A b a 2
Cell volume: 2602.8
Cell parameters: 18.125; 13.0397; 11.0126; 90; 90; 90;  

COD ID: 4504272
CIF file Formula: - C40 H22 Mn N8 O4 -
Comments: Wei, Yongqin; Yu, Yunfang; Wu, Kechen Highly Stable Diamondoid Network Coordination Polymer [Mn(NCP)2]nwith Notable NLO, Magnetic, and Luminescence Properties Crystal Growth & Design 7(11) (2007) 2262
Space group: A b a 2
Cell volume: 3120.6
Cell parameters: 15.4071; 20.45; 9.9044; 90; 90; 90;  

COD ID: 4504735
CIF file Formula: - C11 H10 N4 O -
Comments: Custelcean, Radu; Moyer, Bruce A.; Bryantsev, Vyacheslav S.; Hay, Benjamin P. Anion Coordination in Metal−Organic Frameworks Functionalized with Urea Hydrogen-Bonding Groups Crystal Growth & Design 6(2) (2006) 555
Space group: A b a 2
Cell volume: 965.1
Cell parameters: 13.8; 6.999; 9.992; 90; 90; 90;  

COD ID: 4504801
CIF file Formula: - C11 H10 N4 O -
Comments: Reddy, L. Sreenivas; Basavoju, Srinivas; Vangala, Venu R.; Nangia, Ashwini Hydrogen Bonding in Crystal Structures ofN,N‘-Bis(3-pyridyl)urea. Why Is the N−H···O Tape Synthon Absent in Diaryl Ureas with Electron-Withdrawing Groups? Crystal Growth & Design 6(1) (2006) 161
Space group: A b a 2
Cell volume: 962
Cell parameters: 13.707; 7.014; 10.006; 90; 90; 90;  

COD ID: 4505207
CIF file Formula: - C15 H26 Cl N3 -
Comments: Said, Farouq F.; Ong, Tiow-Gan; Yap, Glenn P. A.; Richeson, Darrin Strong and Weak Hydrogen-Bonding Interactions in the Structures ofN,N‘,N‘ ‘-Trisubstituted Guanidinium Chlorides and Bromides Crystal Growth & Design 5(5) (2005) 1881
Space group: A b a 2
Cell volume: 6774
Cell parameters: 11.978; 37.836; 14.948; 90; 90; 90;  

COD ID: 4505573
CIF file Formula: - C14 H12 In N5 O8 -
Comments: Cepeda, Javier; Beobide, Garikoitz; Castillo, Oscar; Luque, Antonio; Pérez-Yáñez, Sonia; Román, Pascual Structure-Directing Effect of Organic Cations in the Assembly of Anionic In(III)/Diazinedicarboxylate Architectures Crystal Growth & Design 12(3) (2012) 1501
Space group: A b a 2
Cell volume: 1713
Cell parameters: 12.928; 10.806; 12.262; 90; 90; 90;  

COD ID: 4507431
CIF file Formula: - C192 H144 Cu4 N28 O12 -
Comments: He, Qi-Ting; Li, Xiang-Ping; Chen, Lian-Fen; Zhang, Li; Wang, Wei; Su, Cheng-Yong Nanosized Coordination Cages Incorporating Multiple Cu(I) Reactive Sites: Host‒Guest Modulated Catalytic Activity ACS Catalysis 3(1) (2013) 1
Space group: A b a 2
Cell volume: 16536
Cell parameters: 26.531; 29.2825; 21.2848; 90; 90; 90;  

COD ID: 4508601
CIF file Formula: - C50 H50 N8 Ni O8 -
Comments: Goswami, Arijit; Bala, Sukhen; Pachfule, Pradip; Mondal, Raju Comprehensive Study on Mutual Interplay of Multiple V-Shaped Ligands on the Helical Nature of a Series of Coordination Polymers and Their Properties Crystal Growth & Design 13(12) (2013) 5487
Space group: A b a 2
Cell volume: 4763.8
Cell parameters: 19.562; 15.8621; 15.3525; 90; 90; 90;  

COD ID: 4509067
CIF file Formula: - C68 H42 Co5 N18 O5 -
Comments: Mo, Hao-Jun; Zhong, Yong-Rui; Cao, Man-Li; Ou, Yong-Cong; Ye, Bao-Hui Hydrothermal Syntheses and Structural Diversity of Cobalt Complexes with 2,2′-Bibenzimidazole Ligand by Temperature Tuning Strategy Crystal Growth & Design 9(1) (2009) 488
Space group: A b a 2
Cell volume: 6319.2
Cell parameters: 17.9653; 19.8784; 17.6947; 90; 90; 90;  

COD ID: 4509651
CIF file Formula: - C23 H27 N4 O5 S -
Comments: Soegiarto, Airon C.; Ward, Michael D. Directed Organization of Dye Aggregates in Hydrogen-Bonded Host Frameworks Crystal Growth & Design 9(8) (2009) 3803
Space group: A b a 2
Cell volume: 4512.8
Cell parameters: 13.1383; 27.585; 12.4518; 90; 90; 90;  

COD ID: 4509695
CIF file Formula: - C16 H24 Cd N6 O5 -
Comments: Liang, Xiao-Qiang; Li, Dong-Ping; Zhou, Xin-Hui; Sui, Yan; Li, Yi-Zhi; Zuo, Jing-Lin; You, Xiao-Zeng Metal−Organic Coordination Polymers Generated from Chiral Camphoric Acid and Flexible Ligands with Different Spacer Lengths: Syntheses, Structures, and Properties Crystal Growth & Design 9(11) (2009) 4872
Space group: A b a 2
Cell volume: 4467.8
Cell parameters: 17.212; 13.6942; 18.955; 90; 90; 90;  

COD ID: 4510445
CIF file Formula: - C30 H41 Ag2 N10 O4 -
Comments: Han, Lu-Lu; Zhang, Xi-Ying; Chen, Jiang-Shan; Li, Zhong-Hui; Sun, Dao-Feng; Wang, Xing-Po; Sun, Di Silver(I)/Bipyrazole/Dicarboxylate Interpenetrated Coordination Networks: Spontaneous Chiral Resolution, Modulation of Topologies, Water Clusters, and Photoluminescences Crystal Growth & Design 14(5) (2014) 2230
Space group: A b a 2
Cell volume: 7416.6
Cell parameters: 23.326; 32.24; 9.8621; 90; 90; 90;  

COD ID: 4510446
CIF file Formula: - C31 H43 Ag2 N10 O4 -
Comments: Han, Lu-Lu; Zhang, Xi-Ying; Chen, Jiang-Shan; Li, Zhong-Hui; Sun, Dao-Feng; Wang, Xing-Po; Sun, Di Silver(I)/Bipyrazole/Dicarboxylate Interpenetrated Coordination Networks: Spontaneous Chiral Resolution, Modulation of Topologies, Water Clusters, and Photoluminescences Crystal Growth & Design 14(5) (2014) 2230
Space group: A b a 2
Cell volume: 7747
Cell parameters: 22.712; 34.599; 9.858; 90; 90; 90;  

COD ID: 4510551
CIF file Formula: - C15 H14 N4 O3 -
Comments: Rubčić, Mirta; Galić, Nives; Halasz, Ivan; Jednačak, Tomislav; Judaš, Nenad; Plavec, Janez; Šket, Primož; Novak, Predrag Multiple Solid Forms of 1,5-Bis(salicylidene)carbohydrazide: Polymorph-Modulated Thermal Reactivity Crystal Growth & Design 14(6) (2014) 2900
Space group: A b a 2
Cell volume: 1413.01
Cell parameters: 14.5908; 9.3764; 10.3283; 90; 90; 90;  

COD ID: 4511676
CIF file Formula: - C9 H10 Cd N2 O6 -
Comments: Croitor, Lilia; Coropceanu, Eduard B.; Masunov, Artëm E.; Rivera-Jacquez, Hector J.; Siminel, Anatolii V.; Zelentsov, Vyacheslav I.; Datsko, Tatiana Ya.; Fonari, Marina S. Polymeric Luminescent Zn(II) and Cd(II) Dicarboxylates Decorated by Oxime Ligands: Tuning the Dimensionality and Adsorption Capacity Crystal Growth & Design 14(8) (2014) 3935
Space group: A b a 2
Cell volume: 2466.45
Cell parameters: 21.9763; 10.4278; 10.7628; 90; 90; 90;  

COD ID: 6000550
CIF file Formula: - C8 H15 N -
Comments: Mora, A. J.; Fitch, A. N. The low-temperature structures of bicyclo[3.3.1]nonan-9-one and 3-azabicyclo[3.2.2]nonane Zeitschrift für Kristallographie 214(8) (1999) 480-485
Space group: A b a 2
Cell volume: 1445.07
Cell parameters: 21.1318; 11.2357; 6.0863; 90; 90; 90;  

COD ID: 7001102
CIF file Formula: - C14 H8 N2 O8 -
Comments: Dawid, Urszula; Pruchnik, Florian P.; Starosta, Radosław Structure and properties of 2,2′-bipyridine-3,3′,6,6′-tetracarboxylic acid and its iron(II) and cobalt(II) complexes Dalton Transactions (issue 17) (2009) 3348-3353
Space group: A b a 2
Cell volume: 1306.6
Cell parameters: 9.316; 17.611; 7.964; 90; 90; 90;  

COD ID: 7002871
CIF file Formula: - C62 H58 B2 N6 Ru -
Comments: Zhou, Yan; Xiao, Hong-Ping; Kang, Ling-Chen; Zuo, Jing-Lin; Li, Cheng-Hui; You, Xiao-Zeng Synthesis and characterization of neutral iron(ii) and ruthenium(ii) complexes with the isocyanotriphenylborate ligand Dalton Transactions (issue 46) (2009) 10256-10262
Space group: A b a 2
Cell volume: 5431.9
Cell parameters: 16.589; 17.758; 18.439; 90; 90; 90;  

COD ID: 7003868
CIF file Formula: - C20 H42 Co N4 -
Comments: Li, Zhengwen; Lee, Don Kuen; Coulter, Michael; Rodriguez, Leonard N. J.; Gordon, Roy G. Synthesis and characterization of volatile liquid cobalt amidinates Dalton Transactions (issue 19) (2008) 2592-2597
Space group: A b a 2
Cell volume: 2418.1
Cell parameters: 14.528; 13.9928; 11.8948; 90; 90; 90;  

COD ID: 7005034
CIF file Formula: - C38 H60 N2 O2 Zn2 -
Comments: Doyle, David J.; Gibson, Vernon C.; White, Andrew J. P. Synthesis and structures of bimetallic and polymeric zinc coordination compounds supported by salicylaldiminato and anilido-aldimine ligands. Dalton transactions (Cambridge, England : 2003) (issue 3) (2007) 358-363
Space group: A b a 2
Cell volume: 7886.8
Cell parameters: 18.132; 18.8215; 23.11; 90; 90; 90;  

COD ID: 7005206
CIF file Formula: - C48 H74 Cl2 Cu2 N12 O11 -
Comments: Derossi, Sofia; Farrell, David T.; Harding, Charles J.; McKee, Vickie; Nelson, Jane N-methylation of macrobicycles reduces encapsulation ability. Dalton transactions (Cambridge, England : 2003) (issue 18) (2007) 1762-1772
Space group: A b a 2
Cell volume: 5886.6
Cell parameters: 22.37; 15.246; 17.26; 90; 90; 90;  

COD ID: 7006444
CIF file Formula: - C32 H82 Li2 O8 Si6 -
Comments: Bowman, Lyndsey J.; Izod, Keith; Clegg, William; Harrington, Ross W.; Smith, J. David; Eaborn, C. Alkali metal complexes of sterically hindered mono- and di-carbanions containing Si-O bonds. Dalton transactions (Cambridge, England : 2003) (issue 3) (2006) 502-508
Space group: A b a 2
Cell volume: 9788
Cell parameters: 22.008; 23.186; 19.182; 90; 90; 90;  

COD ID: 7007668
CIF file Formula: - C19 H30 Cl2 I2 P2 Se2 -
Comments: Barnes, Nicholas A.; Godfrey, Stephen M.; Halton, Ruth T. A.; Mushtaq, Imrana; Pritchard, Robin G. The reaction of tertiary phosphines with (Ph2Se2I2)2‒the influence of steric and electronic effects. Dalton transactions (Cambridge, England : 2003) (issue 40) (2006) 4795-4804
Space group: A b a 2
Cell volume: 2849.7
Cell parameters: 12.0129; 20.2339; 11.7239; 90; 90; 90;  

COD ID: 7008457
CIF file Formula: - C48 H34 Cd N12 O2 -
Comments: Ye, Qiong; Tang, Yu-Zhi; Wang, Xi-Sen; Xiong, Ren-Gen Strong enhancement of second-harmonic generation (SHG) response through multi-chiral centers and metal-coordination. Dalton transactions (Cambridge, England : 2003) (issue 9) (2005) 1570-1573
Space group: A b a 2
Cell volume: 4136.3
Cell parameters: 12.144; 40.776; 8.353; 90; 90; 90;  

COD ID: 7009127
CIF file Formula: - C31 H35 Cl0 O4.5 P2 Pd2 S4 -
Comments: Su, Weiping; Cao, Rong; Hong, Maochun; Wu, Daxu; Lu, Jiaxi A new access to palladium‒phosphine chemistry. Formation of polynuclear palladium compounds via the oxidation of ligands in simple palladium(II) complexes Journal of the Chemical Society, Dalton Transactions (issue 9) (2000) 1527
Space group: A b a 2
Cell volume: 6870
Cell parameters: 15.905; 22.848; 18.904; 90; 90; 90;  

COD ID: 7012059
CIF file Formula: - C44 H62 B2 Mo N2 O2 -
Comments: Cole, Sarah C.; Coles, Martyn P.; Hitchcock, Peter B. Transition-metal imido-boroxide complexes: a structural and spectroscopic investigation of the influence of boron Journal of the Chemical Society, Dalton Transactions (issue 22) (2002) 4168
Space group: A b a 2
Cell volume: 4415.4
Cell parameters: 19.0505; 27.3517; 8.4738; 90; 90; 90;  

COD ID: 7012756
CIF file Formula: - C4 H8 O8 V -
Comments: del Río, Diego; Galindo, Agustín; Vicente, Ramón; Mealli, Carlo; Ienco, Andrea; Masi, Dante Synthesis, molecular structure and properties of oxo-vanadium(iv) complexes containing the oxydiacetate ligand Dalton Transactions (issue 9) (2003) 1813
Space group: A b a 2
Cell volume: 834.5
Cell parameters: 8.919; 10.889; 8.593; 90; 90; 90;  

COD ID: 7014778
CIF file Formula: - C32 H36 I N5 Pd -
Comments: Cross, Warren B.; Daly, Christopher G.; Ackerman, Rachel L.; George, Ian R.; Singh, Kuldip N-heterocyclic carbene tethered amido complexes of palladium and platinum. Dalton transactions (Cambridge, England : 2003) 40(2) (2011) 495-505
Space group: A b a 2
Cell volume: 6106.6
Cell parameters: 29.37; 20.178; 10.3042; 90; 90; 90;  

COD ID: 7015079
CIF file Formula: - C17 H14 N2 O6 Zn -
Comments: Fang, Shao-Ming; Hu, Min; Zhang, Qiang; Du, Miao; Liu, Chun-Sen Ag(I) and Zn(II) coordination polymers with a bulky naphthalene-based dicarboxyl tecton and different 4,4'-bipyridyl-like bridging co-ligands: structural regulation and properties. Dalton transactions (Cambridge, England : 2003) 40(17) (2011) 4527-4541
Space group: A b a 2
Cell volume: 3302.1
Cell parameters: 22.2072; 13.016; 11.4239; 90; 90; 90;  

COD ID: 7015155
CIF file Formula: - C16 H20 N6 Ni S4 -
Comments: Lobana, Tarlok Singh; Kumari, Poonam; Sharma, Rekha; Castineiras, Alfonso; Butcher, Ray Jay; Akitsu, Takashiro; Aritake, Yoshikazu Thiosemicarbazone derivatives of nickel and copper: the unprecedented coordination of furan ring in octahedral nickel(II) and of triphenylphosphine in three-coordinate copper(I) complexes. Dalton transactions (Cambridge, England : 2003) 40(13) (2011) 3219-3228
Space group: A b a 2
Cell volume: 1975
Cell parameters: 14.768; 27.394; 4.882; 90; 90; 90;  

COD ID: 7017740
CIF file Formula: - C90 H144 Cl14 Er8 N4 O13 -
Comments: Zhang, Jie; Zhang, Zhengxing; Chen, Zhenxia; Zhou, Xigeng Oxidation and coupling of β-diketiminate ligand in lanthanide complexes: novel eight-nuclear lanthanide clusters with μ-, μ3-Cl, and μ4-O bridge. Dalton transactions (Cambridge, England : 2003) 41(2) (2012) 357-359
Space group: A b a 2
Cell volume: 14445
Cell parameters: 28.632; 31.254; 16.142; 90; 90; 90;  

COD ID: 7017741
CIF file Formula: - C90 H144 Cl14 Dy8 N4 O13 -
Comments: Zhang, Jie; Zhang, Zhengxing; Chen, Zhenxia; Zhou, Xigeng Oxidation and coupling of β-diketiminate ligand in lanthanide complexes: novel eight-nuclear lanthanide clusters with μ-, μ3-Cl, and μ4-O bridge. Dalton transactions (Cambridge, England : 2003) 41(2) (2012) 357-359
Space group: A b a 2
Cell volume: 14527
Cell parameters: 28.668; 31.282; 16.199; 90; 90; 90;  

COD ID: 7017927
CIF file Formula: - C60 H60 Mn4 N14 O25 -
Comments: Zhang, Xiu-Mei; Wang, Yan-Qin; Li, Xiu-Bing; Gao, En-Qing Manganese(ii) coordination polymers with mixed azide and pyridylbenzoate N-oxide ligands: structures and magnetism. Dalton transactions (Cambridge, England : 2003) 41(7) (2012) 2026-2033
Space group: A b a 2
Cell volume: 6618.5
Cell parameters: 11.5115; 21.5421; 26.6893; 90; 90; 90;  

COD ID: 7021303
CIF file Formula: - C31 H22 Cl3 Cu2 N6 O2 S2 -
Comments: Majouga, Alexander G.; Beloglazkina, Elena K.; Moiseeva, Anna A.; Shilova, Olga V.; Manzheliy, Eugeniy A.; Lebedeva, Maria A.; Davies, E. Stephen; Khlobystov, Andrei N.; Zyk, Nikolay V. Cleavage of the C-S bond with the formation of a binuclear copper complex with 2-thiolato-3-phenyl-5-(pyridine-2-ylmethylene)-3,5-dihydro-4H-imidazole-4-one. A new mimic of the active site of N2O reductase. Dalton transactions (Cambridge, England : 2003) 42(18) (2013) 6290-6293
Space group: A b a 2
Cell volume: 6459.3
Cell parameters: 20.618; 32.001; 9.7898; 90; 90; 90;  

COD ID: 7022753
CIF file Formula: - C30 H18 Co N2 O6 -
Comments: Ribeiro, Marcos A.; Lanznaster, Maurício; Silva, Marcos M. P.; Resende, Jackson A. L. C.; Pinheiro, Maurício V B; Krambrock, Klaus; Stumpf, Humberto O.; Pinheiro, Carlos B. Cobalt lawsone complexes: searching for new valence tautomers. Dalton transactions (Cambridge, England : 2003) 42(15) (2013) 5462-5470
Space group: A b a 2
Cell volume: 2420.6
Cell parameters: 19.559; 14.772; 8.378; 90; 90; 90;  

COD ID: 7022944
CIF file Formula: - C111 H95.5 Cl8 Mn4 N26.5 O34 -
Comments: Wałęsa-Chorab, Monika; Kubicki, Maciej; Korabik, Maria; Patroniak, Violetta Novel self-assembled supramolecular architectures of Mn(II) ions with a hybrid pyrazine-bipyridine ligand. Dalton transactions (Cambridge, England : 2003) 42(26) (2013) 9746-9754
Space group: A b a 2
Cell volume: 12933.2
Cell parameters: 18.5171; 30.0858; 23.2151; 90; 90; 90;  

COD ID: 7025162
CIF file Formula: - C28 H24 Fe N6 O4 -
Comments: Zhang, Li; Xu, Guan-Cheng; Xu, Hong-Bin; Mereacre, Valeriu; Wang, Zhe-Ming; Powell, Annie K.; Gao, Song Synthesis, magnetic and photomagnetic study of new iron(ii) spin-crossover complexes with N4O2 coordination sphere Dalton Transactions 39(20) (2010) 4856
Space group: A b a 2
Cell volume: 2407.5
Cell parameters: 12.398; 18.807; 10.325; 90; 90; 90;  

COD ID: 7025163
CIF file Formula: - C28 H24 Fe N6 O4 -
Comments: Zhang, Li; Xu, Guan-Cheng; Xu, Hong-Bin; Mereacre, Valeriu; Wang, Zhe-Ming; Powell, Annie K.; Gao, Song Synthesis, magnetic and photomagnetic study of new iron(ii) spin-crossover complexes with N4O2 coordination sphere Dalton Transactions 39(20) (2010) 4856
Space group: A b a 2
Cell volume: 2505
Cell parameters: 12.58; 18.805; 10.589; 90; 90; 90;  

COD ID: 7025199
CIF file Formula: - C12 H16 Cl F5 N2 Pd -
Comments: Blank, Frederik; Scherer, Harald; Ruiz, José; Rodríguez, Venancio; Janiak, Christoph Palladium(II) complexes with pentafluorophenyl ligands: structures, C6F5 fluxionality by 2D-NMR studies and pre-catalysts for the vinyl addition polymerization of norbornene. Dalton transactions (Cambridge, England : 2003) 39(15) (2010) 3609-3619
Space group: A b a 2
Cell volume: 2996.6
Cell parameters: 12.545; 19.9097; 11.9976; 90; 90; 90;  

COD ID: 7025463
CIF file Formula: - C46 H50 Cr2 N8 O10 S8 -
Comments: Clément, Nicolas; Toussaint, Clément; Rogez, Guillaume; Loose, Claudia; Kortus, Jens; Brelot, Lydia; Choua, Sylvie; Dagorne, Samuel; Turek, Philippe; Welter, Richard Novel Cr(III) dinuclear complexes supported by salicyloylhydrazono dithiolane and dithiane ligands: synthesis, stability, crystal structures and magnetic properties. Dalton transactions (Cambridge, England : 2003) 39(19) (2010) 4579-4585
Space group: A b a 2
Cell volume: 5475
Cell parameters: 23.3019; 10.3977; 22.5974; 90; 90; 90;  

COD ID: 7026692
CIF file Formula: - C56 H32 Cl9 F8 Ir2 N4 O4 -
Comments: Chen, Tsun-Ren; Lee, Hsiu-Pen; Chen, Jhy-Der; Chen, Kelvin H.-C. An 18+δ iridium dimer releasing metalloradicals spontaneously. Dalton transactions (Cambridge, England : 2003) 39(40) (2010) 9458-9461
Space group: A b a 2
Cell volume: 5377.81
Cell parameters: 21.8706; 14.4783; 16.9835; 90; 90; 90;  

COD ID: 7026993
CIF file Formula: - C10 H9 Au N2 -
Comments: Ecken, Holger; Olmstead, Marilyn M.; Noll, Bruce C.; Attar, Saeed; Schlyer, Bruce; Balch, Alan L. Effects of anions on the solid state structures of linear gold(I) complexes of the type (o-xylyl isocyanide)gold(I) (monoanion) Journal of the Chemical Society, Dalton Transactions (issue 22) (1998) 3715
Space group: A b a 2
Cell volume: 5069.2
Cell parameters: 13.9609; 26.6259; 13.6371; 90; 90; 90;  

COD ID: 7027526
CIF file Formula: - C39 H34 F12 N10 P2 Ru -
Comments: Fletcher, Nicholas C.; Robinson, Toby C.; Behrendt, Andreas; Jeffery, John C.; Reeves, Zoe R.; Ward, Michael D. Structural, electrochemical and UV/VIS/NIR spectroelectrochemical properties of diastereomerically pure dinuclear ruthenium complexes based on the bridging ligand phenanthroline-5,6-diimine, and a mononuclear by-product with a peripheral isoimidazole group Journal of the Chemical Society, Dalton Transactions (issue 17) (1999) 2999
Space group: A b a 2
Cell volume: 4286.4
Cell parameters: 13.862; 15.622; 19.794; 90; 90; 90;  

COD ID: 7034378
CIF file Formula: - C6 H18 As Ce N4 S3 -
Comments: Zhou, Jian; Zhao, Rong-Qing; Yang, Tao; Liu, Xing; Xiao, Hong-Ping; Zou, Hua-Hong; Tan, Xiao-Feng A series of new lanthanoid thioarsenates: insights into the influence of lanthanide contraction on the formation of new lanthanoid thioarsenates. Dalton transactions (Cambridge, England : 2003) 44(16) (2015) 7203-7212
Space group: A b a 2
Cell volume: 2854.47
Cell parameters: 19.758; 9.6623; 14.9521; 90; 90; 90;  

COD ID: 7034379
CIF file Formula: - C6 H18 As N4 Pr S3 -
Comments: Zhou, Jian; Zhao, Rong-Qing; Yang, Tao; Liu, Xing; Xiao, Hong-Ping; Zou, Hua-Hong; Tan, Xiao-Feng A series of new lanthanoid thioarsenates: insights into the influence of lanthanide contraction on the formation of new lanthanoid thioarsenates. Dalton transactions (Cambridge, England : 2003) 44(16) (2015) 7203-7212
Space group: A b a 2
Cell volume: 2844.05
Cell parameters: 19.7203; 9.6404; 14.9599; 90; 90; 90;  

COD ID: 7034380
CIF file Formula: - C6 H18 As N4 Nd S3 -
Comments: Zhou, Jian; Zhao, Rong-Qing; Yang, Tao; Liu, Xing; Xiao, Hong-Ping; Zou, Hua-Hong; Tan, Xiao-Feng A series of new lanthanoid thioarsenates: insights into the influence of lanthanide contraction on the formation of new lanthanoid thioarsenates. Dalton transactions (Cambridge, England : 2003) 44(16) (2015) 7203-7212
Space group: A b a 2
Cell volume: 2826.7
Cell parameters: 19.648; 9.625; 14.947; 90; 90; 90;  

COD ID: 7034381
CIF file Formula: - C6 H18 As N4 S3 Sm -
Comments: Zhou, Jian; Zhao, Rong-Qing; Yang, Tao; Liu, Xing; Xiao, Hong-Ping; Zou, Hua-Hong; Tan, Xiao-Feng A series of new lanthanoid thioarsenates: insights into the influence of lanthanide contraction on the formation of new lanthanoid thioarsenates. Dalton transactions (Cambridge, England : 2003) 44(16) (2015) 7203-7212
Space group: A b a 2
Cell volume: 2755.5
Cell parameters: 19.4659; 9.57; 14.7915; 90; 90; 90;  

COD ID: 7051339
CIF file Formula: - C6 H24 Br4 N4 O -
Comments: New Journal of Chemistry (2000)
Space group: A b a 2
Cell volume: 3274.9
Cell parameters: 14.286; 16.187; 14.162; 90; 90; 90;  

COD ID: 7051340
CIF file Formula: - C6 H24 I4 N4 O -
Comments: New Journal of Chemistry (2000)
Space group: A b a 2
Cell volume: 3812.2
Cell parameters: 15.091; 16.774; 15.06; 90; 90; 90;  

COD ID: 7051399
CIF file Formula: - C8 H8 O4 W -
Comments: New Journal of Chemistry (1999)
Space group: A b a 2
Cell volume: 996.5
Cell parameters: 12.458; 6.37; 12.557; 90; 90; 90;  

COD ID: 7053076
CIF file Formula: - C30 H18 Co N2 O6 -
Comments: Casanova, Isabel; Sousa-Pedrares, Antonio; Viqueira, Joaquin; Durán, María L.; Romero, Jaime; Sousa, Antonio; García-Vázquez, José A. Electrochemical synthesis and structural characterization of homoleptic and heteroleptic cobalt, nickel, copper, zinc and cadmium compounds with the 2-hydroxy-1,4-naphthoquinone ligand New Journal of Chemistry 37(8) (2013) 2303
Space group: A b a 2
Cell volume: 2419.5
Cell parameters: 19.554; 14.761; 8.3825; 90; 90; 90;  

COD ID: 7053080
CIF file Formula: - C30 H18 N2 O6 Zn -
Comments: Casanova, Isabel; Sousa-Pedrares, Antonio; Viqueira, Joaquin; Durán, María L.; Romero, Jaime; Sousa, Antonio; García-Vázquez, José A. Electrochemical synthesis and structural characterization of homoleptic and heteroleptic cobalt, nickel, copper, zinc and cadmium compounds with the 2-hydroxy-1,4-naphthoquinone ligand New Journal of Chemistry 37(8) (2013) 2303
Space group: A b a 2
Cell volume: 2440.5
Cell parameters: 19.6716; 14.8036; 8.3806; 90; 90; 90;  

COD ID: 7053322
CIF file Formula: - C82.5 H10.5 F16 -
Comments: Gruzinskaya, Natalia I.; Silin, Andrey I.; Pimenova, Anna S.; Khavrel, Pavel A.; Markov, Vitaliy Yu.; Sidorov, Lev N.; Kemnitz, Erhard; Troyanov, Sergey I. Synthesis and structure of cycloperfluoroalkylated derivatives of C70, C70(C2F4) and C70(C4F8)n, n = 1‒6 New Journal of Chemistry 34(2) (2010) 243
Space group: A b a 2
Cell volume: 9792.1
Cell parameters: 34.703; 28.282; 9.977; 90; 90; 90;  

COD ID: 7053594
CIF file Formula: - C28 H24 Si -
Comments: Cortial, Guillaume; Le Goff, Xavier-Frederic; Bousquié, Magali; Boisson, Christophe; Le Floch, Pascal; Nief, François; Thuilliez, Julien Neutral ansa-bis(fluorenyl)silane neodymium borohydrides: synthesis, structural study and behaviour as catalysts in butadiene‒ethylene copolymerisation New Journal of Chemistry 34(10) (2010) 2290
Space group: A b a 2
Cell volume: 8479.8
Cell parameters: 18.538; 35.874; 12.751; 90; 90; 90;  

COD ID: 7053627
CIF file Formula: - C20 H14 N4 O4 Zn -
Comments: Aijaz, Arshad; Lama, Prem; Sañudo, E. Carolina; Mishra, Rupali; Bharadwaj, Parimal K. Coordination polymers of various architectures built with mixed imidazole/benzimidazole and carboxylate donor ligands and different metal ions: syntheses, structural features and magnetic properties New Journal of Chemistry 34(11) (2010) 2502
Space group: A b a 2
Cell volume: 3817
Cell parameters: 25.391; 19.896; 7.556; 90; 90; 90;  

COD ID: 7054314
CIF file Formula: - C48 H51 N4 O4 S2 -
Comments: N., Ahipa T.; Adhikari, Airody Vasudeva 2-Methoxypyridine derivatives: synthesis, liquid crystalline and photo-physical properties New J. Chem. 38(10) (2014) 5018
Space group: A b a 2
Cell volume: 4880.2
Cell parameters: 14.8343; 44.69; 7.3614; 90; 90; 90;  

COD ID: 7100197
CIF file Formula: - C11 H10 N4 O -
Comments: Parthasarathi Dastidar; Amitava Das; D.Amilan Jose; D.Krishna Kumar First Snapshot of A Nonpolymeric Hydrogelator Interacting with its Gelling solvents Chemical Communications (2005)
Space group: A b a 2
Cell volume: 957.9
Cell parameters: 13.713; 6.977; 10.013; 90; 90; 90;  

COD ID: 7101347
CIF file Formula: - C42 H42 Mn2 O10 P2 -
Comments: Ch. Elschenbroich; Klaus Harms; Jorg Six On a Novel Coordination Mode of Phosphinine C5H5P Chemical Communications (issue 32) (2006)
Space group: A b a 2
Cell volume: 4160.8
Cell parameters: 19.7993; 27.5435; 7.6297; 90; 90; 90;  

COD ID: 7101418
CIF file Formula: - C16 H12 O4 -
Comments: David Spring; David T. Blackwell; David J. Fox; Xianbin Su.; Kiyotaka Tanaka Copper Catalyzed Oxidation of Organozinc Halides Chemical Communications (issue 37) (2006)
Space group: A b a 2
Cell volume: 1256.62
Cell parameters: 9.778; 13.5482; 9.4858; 90; 90; 90;  

COD ID: 7101729
CIF file Formula: - C64.5 H120 In2 N Ni2 O27 -
Comments: Sañudo, E Carolina; Muryn, Christopher A; Helliwell, Madeleine A; Timco, Grigore A; Wernsdorfer, Wolfgang; Winpenny, Richard E P Al, Ga and In heterometallic wheels and their by-products. Chemical communications (Cambridge, England) (issue 8) (2007) 801-803
Space group: A b a 2
Cell volume: 18339.7
Cell parameters: 26.3713; 23.9207; 29.0728; 90; 90; 90;  

COD ID: 7101994
CIF file Formula: - C135 H117 Mn Mo36 N27 O118 P2 -
Comments: Li, Yang-Guang; Dai, Li-Mei; Wang, Yong-Hui; Wang, Xin-Long; Wang, En-Bo; Su, Zhong-Min; Xu, Lin A new molybdenum-oxide-based organic-inorganic hybrid framework templated by double-Keggin anions. Chemical communications (Cambridge, England) (issue 25) (2007) 2593-2595
Space group: A b a 2
Cell volume: 20652
Cell parameters: 34.826; 35.777; 16.575; 90; 90; 90;  

COD ID: 7102385
CIF file Formula: - C87 H103 O4.5 Ti2 -
Comments: Petrella, Antonella J; Roberts, Nicholas K; Craig, Donald C; Raston, Colin L; Lamb, Robert N Selective 1,3-complexation of p-(t)Bu-calix[4]arene by [TiCp(2)Me(2)]. Chemical communications (Cambridge, England) (issue 1) (2004) 64-65
Space group: A b a 2
Cell volume: 17072.6
Cell parameters: 21.0123; 21.0224; 38.6495; 90; 90; 90;  

COD ID: 7109152
CIF file Formula: - C18 H12 Be N2 O2 S2 -
Comments: Chan Seok Oh; Chil Won Lee; Jun Yeob Lee Simple heteroatom engineering for tuning the triplet energy of organometallic host materials for red, green and blue phosphorescent organic light-emitting diodes Chem.Commun. 49 (2013) 3875
Space group: A b a 2
Cell volume: 1629.9
Cell parameters: 10.2336; 14.137; 11.2663; 90; 90; 90;  

COD ID: 7109556
CIF file Formula: - C38 H26 B F10 P -
Comments: Olga Ekkert; Ottmar Tuschewitzki; Constantin G. Daniliuc; Gerald Kehr; Gerhard Erker Reaction of strongly electrophilic alkenylboranes with phosphanylalkynes: rare examples of intermolecular 1,1-alkenylboration reactions Chem.Commun. 49 (2013) 6992
Space group: A b a 2
Cell volume: 6621.2
Cell parameters: 31.8747; 21.7074; 9.5693; 90; 90; 90;  

COD ID: 7109919
CIF file Formula: - C21 H20 O5 -
Comments: Yu-Ying Ye; Ping-Xin Zhou; Jian-Yi Luo; Mei-Jin Zhong; Yong-Min Liang Palladium-catalyzed insertion of alpha,beta-unsaturated N-tosylhydrazones and trapping with carbon nucleophiles Chem.Commun. 49 (2013) 10190
Space group: A b a 2
Cell volume: 4081.4
Cell parameters: 30.6554; 15.1602; 8.7821; 90; 90; 90;  

COD ID: 7110474
CIF file Formula: - C13 H11 N2 O2 -
Comments: Reznikov, Vladimir A.; Pervukhina, Natalia V.; Ikorskii, Vladimir N.; Ovcharenko, Victor I.; Ovcharenko, Ivan V.; Grand, Andre Persistent vinylnitroxides Chemical Communications (issue 6) (1999) 539
Space group: A b a 2
Cell volume: 2348.6
Cell parameters: 15.334; 18.203; 8.414; 90; 90; 90;  

COD ID: 7110586
CIF file Formula: - C7 Br F4 N2 S2 -
Comments: Antorrena, Guillermo; Palacio, Fernando; Davies, John E.; Hartley, Matthew; Rawson, Jeremy M.; Smith, J.Nicholas B.; Steiner, Alexander A novel paramagnetic dithiadiazolyl radical: Crystal structure and magnetic properties of p-BrC6F4CNSSN• Chemical Communications (issue 15) (1999) 1393
Space group: A b a 2
Cell volume: 1950.4
Cell parameters: 8.263; 20.426; 11.556; 90; 90; 90;  

COD ID: 7111518
CIF file Formula: - C34 H56 O2 -
Comments: Luo, Qian; Wang, Chao; Zhang, Wen-Xiong; Xi, Zhenfeng CuCl-mediated tandem CO insertion and annulation of 1,4-dilithio-1,3-dienes: formation of multiply substituted cyclopentadienones and/or their head-to-head dimers Chemical Communications (issue 13) (2008) 1593-1595
Space group: A b a 2
Cell volume: 6407
Cell parameters: 19.655; 20.326; 16.036; 90; 90; 90;  

COD ID: 7115012
CIF file Formula: - C25.5 H35 Cu N2 -
Comments: Dai, Xuliang; Warren, Timothy H. Dioxygen activation by a neutral β-diketiminato copper(i) ethylene complex Chemical Communications (issue 19) (2001) 1998
Space group: A b a 2
Cell volume: 4808
Cell parameters: 13.7801; 23.792; 14.665; 90; 90; 90;  

COD ID: 7115384
CIF file Formula: - C28 H26 Dy N5 O13 -
Comments: Apoorva Upadhyay; Saurabh Kumar Singh; Chinmoy Das; Ranajit Mondol; Stuart K. Langley; Keith S. Murray; Gopalan Rajaraman; Maheswaran Shanmugam Enhancing the effective energy barrier of a Dy(III) SMM using a bridged diamagnetic Zn(II) ion Chem.Commun. 50 (2014) 8838
Space group: A b a 2
Cell volume: 9120
Cell parameters: 17.654; 54.092; 9.5502; 90; 90; 90;  

COD ID: 7116449
CIF file Formula: - C34 H34 N2 O4 S4 -
Comments: Yu Jiang; Xiang-Ying Tang; Min Shi A Rh-catalyzed 1,2-sulfur migration/aza-Diels-Alder cascade initiated by aza-vinyl carbenoids from sulfur-tethered N-sulfonyl-1,2,3-triazoles Chem.Commun. 51 (2015) 2122
Space group: A b a 2
Cell volume: 7409
Cell parameters: 28.621; 26.533; 9.756; 90; 90; 90;  

COD ID: 7116868
CIF file Formula: - C28 H26 Er N5 O13 -
Comments: Das, Chinmoy; Upadhyay, Apoorva; Vaidya, Shefali; Singh, Saurabh Kumar; Rajaraman, Gopalan; Shanmugam, Maheswaran Origin of SMM behaviour in an asymmetric Er(III) Schiff base complex: a combined experimental and theoretical study Chemical Communications (Cambridge, United Kingdom) 51(28) (2015) 6137-6140
Space group: A b a 2
Cell volume: 9098
Cell parameters: 17.572; 54.043; 9.58; 90; 90; 90;  

COD ID: 7116869
CIF file Formula: - C28 H26 Lu N5 O13 -
Comments: Das, Chinmoy; Upadhyay, Apoorva; Vaidya, Shefali; Singh, Saurabh Kumar; Rajaraman, Gopalan; Shanmugam, Maheswaran Origin of SMM behaviour in an asymmetric Er(III) Schiff base complex: a combined experimental and theoretical study Chemical Communications (Cambridge, United Kingdom) 51(28) (2015) 6137-6140
Space group: A b a 2
Cell volume: 9088
Cell parameters: 17.439; 54.451; 9.5702; 90; 90; 90;  

COD ID: 7150869
CIF file Formula: - C11 H17 B O2 -
Comments: Filthaus, Matthias; Oppel, Iris M.; Bettinger, Holger F. Supramolecular structures and spontaneous resolution: the case of ortho-substituted phenylboronic acids Organic & Biomolecular Chemistry 6(7) (2008) 1201-1207
Space group: A b a 2
Cell volume: 4389.9
Cell parameters: 31.624; 15.1613; 9.1559; 90; 90; 90;  

COD ID: 7152575
CIF file Formula: - C21 H28 Cl N -
Comments: Amara, Zacharias; Drège, Emmanuelle; Troufflard, Claire; Retailleau, Pascal; Joseph, Delphine Solvent-free double aza-Michael under ultrasound irradiation: diastereoselective sequential one-pot synthesis of pyrrolidine Lobelia alkaloids analogues. Organic & biomolecular chemistry 10(35) (2012) 7148-7157
Space group: A b a 2
Cell volume: 1934.07
Cell parameters: 25.438; 10.671; 7.125; 90; 90; 90;  

COD ID: 7152659
CIF file Formula: - C13 H6 F3 N3 S -
Comments: Zhang, Xinhai; Jia, Jiong; Ma, Chen A one-pot regioselective synthesis of benzo[d]imidazo[2,1-b]thiazoles. Organic & biomolecular chemistry 10(39) (2012) 7944-7948
Space group: A b a 2
Cell volume: 2417
Cell parameters: 17.79; 20.166; 6.7371; 90; 90; 90;  

COD ID: 7153062
CIF file Formula: - C56 H88 Cu4 Fe2 N4 P4 S4 -
Comments: Trivedi, Manoj; Singh, Gurmeet; Kumar, Abhinav; Rath, Nigam P. A thiocyanato-bridged copper(i) cubane complex and its application in palladium-catalyzed Sonogashira coupling of aryl halides. Dalton transactions (Cambridge, England : 2003) 42(36) (2013) 12849-12852
Space group: A b a 2
Cell volume: 22208.1
Cell parameters: 32.8531; 32.0553; 21.088; 90; 90; 90;  

COD ID: 7153063
CIF file Formula: - C56 H88 Cu4 Fe2 N4 P4 S4 -
Comments: Trivedi, Manoj; Singh, Gurmeet; Kumar, Abhinav; Rath, Nigam P. A thiocyanato-bridged copper(i) cubane complex and its application in palladium-catalyzed Sonogashira coupling of aryl halides. Dalton transactions (Cambridge, England : 2003) 42(36) (2013) 12849-12852
Space group: A b a 2
Cell volume: 22249
Cell parameters: 32.822; 32.088; 21.1255; 90; 90; 90;  

COD ID: 7153800
CIF file Formula: - C28 H28 N3 O2 -
Comments: Wen, Li-Rong; Lan, Ming-Chao; Yuan, Wen-Kui; Li, Ming DABCO-mediated isocyanide-based multicomponent reaction: synthesis of highly substituted cyclopentenes. Organic & biomolecular chemistry 12(26) (2014) 4628-4632
Space group: A b a 2
Cell volume: 5040.7
Cell parameters: 13.772; 27.468; 13.3251; 90; 90; 90;  

COD ID: 7154181
CIF file Formula: - C21 H19 N O4 -
Comments: Savych, Iryna; Gläsel, Tim; Villinger, Alexander; Sosnovskikh, Vyacheslav Ya; Iaroshenko, Viktor O.; Langer, Peter Synthesis of functionalized 2-salicyloylfurans, furo[3,2-b]chromen-9-ones and 2-benzoyl-8H-thieno[2,3-b]indoles by one-pot cyclizations of 3-halochromones with β-ketoamides and 1,3-dihydroindole-2-thiones. Organic & biomolecular chemistry 13(3) (2015) 729-750
Space group: A b a 2
Cell volume: 6898.3
Cell parameters: 53.5172; 17.0124; 7.5768; 90; 90; 90;  

COD ID: 7200497
CIF file Formula: - C30 H28 Cu N6 O8 S6 -
Comments: Carballo, Rosa; Covelo, Berta; Fernández-Hermida, Nuria; Lago, Ana B.; Vázquez-López, Ezequiel M. From copper(II) carboxylate to copper(II) 4-pyridylsulfonate coordination polymers as a consequence of the copper(II)-assisted oxidative cleavage of the 4,4'-dipyridyldisulfide ligand CrystEngComm 11(5) (2009) 817-826
Space group: A b a 2
Cell volume: 3544.3
Cell parameters: 20.144; 16.6614; 10.5603; 90; 90; 90;  

COD ID: 7200705
CIF file Formula: - C39 H48 Cl4 N12 O4 Zn2 -
Comments: Liang, Jianjun; Wu, Biao; Jia, Chuandong; Yang, Xiao-Juan Metallomacrocycle or helix: Supramolecular isomerism in bis(pyridylurea) metal complexes CrystEngComm 11(6) (2009) 975
Space group: A b a 2
Cell volume: 4721
Cell parameters: 12.9497; 41.02; 8.8874; 90; 90; 90;  

COD ID: 7200706
CIF file Formula: - C40 H50 Cl4 N12 O4 Zn2 -
Comments: Liang, Jianjun; Wu, Biao; Jia, Chuandong; Yang, Xiao-Juan Metallomacrocycle or helix: Supramolecular isomerism in bis(pyridylurea) metal complexes CrystEngComm 11(6) (2009) 975
Space group: A b a 2
Cell volume: 4627.5
Cell parameters: 12.965; 40.535; 8.8052; 90; 90; 90;  

COD ID: 7201691
CIF file Formula: - C16 H15 N O3 -
Comments: Munshi, Parthapratim; Skelton, Brian W.; McKinnon, Joshua J.; Spackman, Mark A. Polymorphism in 3-methyl-4-methoxy-4′-nitrostilbene (MMONS), a highly active NLO material CrystEngComm 10(2) (2008) 197
Space group: A b a 2
Cell volume: 2744.23
Cell parameters: 15.4037; 13.4121; 13.2831; 90; 90; 90;  

COD ID: 7201896
CIF file Formula: - C16 H17 Cd N3 O4 -
Comments: Brown, Kyalamboka A.; Martin, David P.; Supkowski, Ronald M.; LaDuca, Robert L. Two- and three-dimensional divalent metal coordination polymers constructed from 2,2-dimethylsuccinate and dipyridylamine ligands CrystEngComm 10(7) (2008) 846
Space group: A b a 2
Cell volume: 3343
Cell parameters: 17.076; 16.577; 11.809; 90; 90; 90;  

COD ID: 7202281
CIF file Formula: - C15 H13 N3 O4 Zn -
Comments: Brown, Kyalamboka A.; Martin, David P.; LaDuca, Robert L. An acentric parallel interpenetrated dual-ligand zinc coordination polymer from an in situ terminal-to-internal alkene rearrangement CrystEngComm 10(10) (2008) 1305
Space group: A b a 2
Cell volume: 3192
Cell parameters: 16.846; 16.926; 11.193; 90; 90; 90;  

COD ID: 7202870
CIF file Formula: - C28 H24 N6 O4 Zn -
Comments: Barbazán, Paula; Carballo, Rosa; Vázquez-López, Ezequiel M. Synthesis and structure of 2-acetylpyridine-salicyloylhydrazone and its copper(ii) and zinc(ii) complexes. The effect of the metal coordination on the weak intermolecular interactions CrystEngComm 9(8) (2007) 668
Space group: A b a 2
Cell volume: 2519
Cell parameters: 12.598; 18.483; 10.818; 90; 90; 90;  

COD ID: 7205428
CIF file Formula: - C18 H4 F10 O6 -
Comments: Dikundwar, Amol G.; Venkateswarlu, Ch.; Piltz, Ross O.; Chandrasekaran, Srinivasan; Guru Row, Tayur N. Crystal structures of fluorinated aryl biscarbonates and a biscarbamate: a counterpoise between weak intermolecular interactions and molecular symmetry CrystEngComm 13(5) (2011) 1531
Space group: A b a 2
Cell volume: 1782.62
Cell parameters: 16.3233; 9.9385; 10.9883; 90; 90; 90;  

COD ID: 7205429
CIF file Formula: - C18 H4 F10 O6 -
Comments: Dikundwar, Amol G.; Venkateswarlu, Ch.; Piltz, Ross O.; Chandrasekaran, Srinivasan; Guru Row, Tayur N. Crystal structures of fluorinated aryl biscarbonates and a biscarbamate: a counterpoise between weak intermolecular interactions and molecular symmetry CrystEngComm 13(5) (2011) 1531
Space group: A b a 2
Cell volume: 1782.62
Cell parameters: 16.3233; 9.9385; 10.9883; 90; 90; 90;  

COD ID: 7205571
CIF file Formula: - C17 H30 N4 O5 S -
Comments: Soegiarto, Airon C.; Yan, Wah; Kent, Andrew D.; Ward, Michael D. Regulating low-dimensional magnetic behavior of organic radicals in crystalline hydrogen-bonded host frameworks Journal of Materials Chemistry 21(7) (2011) 2204
Space group: A b a 2
Cell volume: 4484.3
Cell parameters: 13.1747; 27.939; 12.1826; 90; 90; 90;  

COD ID: 7206818
CIF file Formula: - C41 H28 N4 O8 Zn2 -
Comments: Xiong, Shunshun; Li, Shujuan; Wang, Sujing; Wang, Zhiyong Multi-functional metal‒organic frameworks based on H4mdip: Crystal structure, photoluminescence, selective ion-exchange and catalysis CrystEngComm 13(24) (2011) 7236
Space group: A b a 2
Cell volume: 4522
Cell parameters: 14.687; 18.524; 16.622; 90; 90; 90;  

COD ID: 7206903
CIF file Formula: - C50 H50 N8 Ni O8 -
Comments: Goswami, Arijit; Sengupta, Satirtha; Mondal, Raju Construction of helical networks by using multiple V-shaped mixed ligand systems CrystEngComm 14(2) (2012) 561
Space group: A b a 2
Cell volume: 4763.8
Cell parameters: 19.562; 15.8621; 15.3525; 90; 90; 90;  

COD ID: 7207302
CIF file Formula: - B2 O7 Pb4 -
Comments: Yu, Hongwei; Pan, Shilie; Wu, Hongping; Zhao, Wenwu; Zhang, Fangfang; Li, Hongyi; Yang, Zhihua A new congruent-melting oxyborate, Pb4O(BO3)2 with optimally aligned BO3 triangles adopting layered-type arrangement Journal of Materials Chemistry 22(5) (2012) 2105
Space group: A b a 2
Cell volume: 1661.3
Cell parameters: 15.4598; 10.805; 9.9452; 90; 90; 90;  

COD ID: 7207331
CIF file Formula: - C14 H12 Ag2 N8 S2 -
Comments: Bai, Yan; Wang, Jun-Li; Dang, Dong-Bin; Li, Meng-Meng; Niu, Jing-Yang Assembly of four d10-metal inorganic‒organic hybrid coordination polymers based on bipyrazine imine-based ligand: Synthesis, crystal structures and luminescent properties CrystEngComm 14(5) (2012) 1575
Space group: A b a 2
Cell volume: 1871.76
Cell parameters: 12.2275; 21.7867; 7.0262; 90; 90; 90;  

COD ID: 7208721
CIF file Formula: - C64 H60 N8 Ni O3 -
Comments: Kounavi, Konstantina A.; Moushi, Eleni E.; Manos, Manolis J.; Papatriantafyllopoulou, Constantina; Tasiopoulos, Anastasios J.; Nastopoulos, Vassilios Supramolecular patterns of cationic and neutral Ni(ii) complexes from the interplay of hydrogen-bonding, stacking interactions and metal-coordination motifs CrystEngComm 14(20) (2012) 6492
Space group: A b a 2
Cell volume: 6059.4
Cell parameters: 11.4027; 23.4885; 22.6238; 90; 90; 90;  

COD ID: 7208722
CIF file Formula: - C68 H68 Cl4 N8 Ni2 O2 -
Comments: Kounavi, Konstantina A.; Moushi, Eleni E.; Manos, Manolis J.; Papatriantafyllopoulou, Constantina; Tasiopoulos, Anastasios J.; Nastopoulos, Vassilios Supramolecular patterns of cationic and neutral Ni(ii) complexes from the interplay of hydrogen-bonding, stacking interactions and metal-coordination motifs CrystEngComm 14(20) (2012) 6492
Space group: A b a 2
Cell volume: 6295.03
Cell parameters: 11.6264; 24.3482; 22.2375; 90; 90; 90;  

COD ID: 7208723
CIF file Formula: - C64 H62.8 Br2 N8 Ni O3.4 -
Comments: Kounavi, Konstantina A.; Moushi, Eleni E.; Manos, Manolis J.; Papatriantafyllopoulou, Constantina; Tasiopoulos, Anastasios J.; Nastopoulos, Vassilios Supramolecular patterns of cationic and neutral Ni(ii) complexes from the interplay of hydrogen-bonding, stacking interactions and metal-coordination motifs CrystEngComm 14(20) (2012) 6492
Space group: A b a 2
Cell volume: 6079.9
Cell parameters: 11.4808; 23.4663; 22.5673; 90; 90; 90;  

COD ID: 7208728
CIF file Formula: - C66 H61.6 I2 N8 Ni O2.8 -
Comments: Kounavi, Konstantina A.; Moushi, Eleni E.; Manos, Manolis J.; Papatriantafyllopoulou, Constantina; Tasiopoulos, Anastasios J.; Nastopoulos, Vassilios Supramolecular patterns of cationic and neutral Ni(ii) complexes from the interplay of hydrogen-bonding, stacking interactions and metal-coordination motifs CrystEngComm 14(20) (2012) 6492
Space group: A b a 2
Cell volume: 6247.6
Cell parameters: 23.8271; 11.3058; 23.1922; 90; 90; 90;  

COD ID: 7209324
CIF file Formula: - C12 H8 Cd N10 S2 -
Comments: Ana B. Caballero; Antonio Rodríguez-Diéguez; Elisa Barea; Miguel Quirós; Juan M. Salas Influence of Pseudohalide Ligands on the Structural Versatility and Properties of Novel Ternary Metal Complexes with 1,2,4-Triazolo[1,5-a]pyrimidine CrystEngComm 12 (2010) 3038-3045
Space group: A b a 2
Cell volume: 1694.7
Cell parameters: 8.3799; 19.526; 10.357; 90; 90; 90;  

COD ID: 7210104
CIF file Formula: - C6 H8 Mn N10 O2 -
Comments: Liao, Jian-Zhen; Ke, Hua; Liu, Jian-Jun; Li, Zuo-Yin; Lin, Mei-Jin; Wang, Jun-Dong; Huang, Chang-Cang Coordination polymers of tetrazole-yl acylamide with octahedrally coordinated divalent transition metals: the effects of metal centers and side-groups on the structural topologies and symmetries CrystEngComm 15(24) (2013) 4830
Space group: A b a 2
Cell volume: 1048.5
Cell parameters: 9.3707; 12.181; 9.1857; 90; 90; 90;  

COD ID: 7211734
CIF file Formula: - C40 H38 Mn2 N4 O16 S -
Comments: Fu, Feng; Li, Dong-Sheng; Wu, Ya-Pan; Gao, Xiao-Ming; Du*, Miao; Tang, Long; Zhang, Xiao-Ning; Meng, Cai-Xia A versatile V-shaped tetracarboxylate building block for constructing mixed-ligand Co(ii) and Mn(ii) complexes incorporating various N-donor co-ligands CrystEngComm 12(4) (2010) 1227
Space group: A b a 2
Cell volume: 4276.5
Cell parameters: 17.581; 27.365; 8.8889; 90; 90; 90;  

COD ID: 7212422
CIF file Formula: - C27 H28 N2 O6 Zn -
Comments: Zheng, Yue-Qing; Zhang, Jie; Liu, Ji-Yong New Zn(ii) coordination polymers with 1,3-bis(4-pyridyl)-propane: syntheses, crystal structures and properties CrystEngComm 12(10) (2010) 2740
Space group: A b a 2
Cell volume: 5203.4
Cell parameters: 29.812; 9.6688; 18.052; 90; 90; 90;  

COD ID: 7213938
CIF file Formula: - C96 H66 As8 Cu4 N16 O43 V14 -
Comments: Guo, Hai-Yang; Li, Zhi-Fang; Zhao, De-Chuan; Hu, Yang-Yang; Xiao, Li-Na; Cui, Xiao-Bing; Guan, Jing-Qi; Xu, Ji-Qing The synthesis and characterization of three organic‒inorganic hybrids based on different transition metal complexes and {As8V14O42(H2O)} clusters CrystEngComm 16(11) (2014) 2251
Space group: A b a 2
Cell volume: 12263.1
Cell parameters: 26.4776; 16.8267; 27.5248; 90; 90; 90;  

COD ID: 7215020
CIF file Formula: - C18 H23 Co2 N5 O13 -
Comments: Huang, Fu-Ping; Li, Hai-Ye; Yu, Qing; Bian, He-Dong; Tian, Jin-Lei; Yan, Shi-Ping; Liao, Dai-Zheng; Cheng, Peng Co(ii)/Ni(ii) coordination polymers incorporated with a bent connector: crystal structures and magnetic properties CrystEngComm 14(14) (2012) 4756
Space group: A b a 2
Cell volume: 2472.6
Cell parameters: 23.501; 10.181; 10.334; 90; 90; 90;  

COD ID: 7215302
CIF file Formula: - C30.8 H37.8 Cd N6.2 O6.2 -
Comments: Cui, Ke-Hui; Yao, Shi-Yan; Li, Hai-Qin; Li, Yan-Tao; Zhao, Hai-Ping; Jiang, Chun-Jie; Tian, Yun-Qi Acentric and chiral four-connected metal‒organic frameworks based on the racemic binaphthol-like chiral ligand of 4-(1-H(or methyl)-imidaozol-1-yl)benzoic acid CrystEngComm 13(10) (2011) 3432
Space group: A b a 2
Cell volume: 5945.7
Cell parameters: 15.573; 19.416; 19.664; 90; 90; 90;  

COD ID: 7216398
CIF file Formula: - C19 H19 Cl3 Cu N2 O4 -
Comments: Lochenie, Charles; Schlamp, Stephan; Railliet, Antoine P.; Robeyns, Koen; Weber, Birgit; Garcia, Yann Water channels and zipper structures in Schiff base-like Cu(ii) and Ni(ii) mononuclear complexes CrystEngComm (2014)
Space group: A b a 2
Cell volume: 4230.4
Cell parameters: 27.317; 22.2583; 6.9575; 90; 90; 90;  

COD ID: 7222752
CIF file Formula: - Br2 Se2 -
Comments: Kniep, R.; Korte, L.; Mootz, D. Kristallstrukturen von Verbindungen A2 X2 (A= S,Se; X= Cl,Br) Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (33,1978-41,1986) 38 (1983) 1-6
Space group: A b a 2
Cell volume: 503.725
Cell parameters: 14.069; 6.744; 5.309; 90; 90; 90;  

COD ID: 7222753
CIF file Formula: - Br2 S2 -
Comments: Kniep, R.; Korte, L.; Mootz, D. Kristallstrukturen von Verbindungen A2 X2 (A= S,Se; X= Cl,Br) Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (33,1978-41,1986) 38 (1983) 1-6
Space group: A b a 2
Cell volume: 480.285
Cell parameters: 13.49; 6.788; 5.245; 90; 90; 90;  

COD ID: 8000073
CIF file Formula: - C32 H40 Cl2 N6 O11 Tc -
Comments: Takashi Yoshimura; Masanori Kawai; Tsutomu Takayama; Tsutomu Sekine; Hiroshi Kudo; Atsushi Shinohara A Novel Seven-coordinate Technetium(IV) Complex: Synthesis and Characterization of [TcO(tpen)]2+ (tpen δb N,N,N',N'-Tetrakis(2-pyridylmethyl)ethylenediamine) Chemistry Letters 34(12) (2005) 1624
Space group: A b a 2
Cell volume: 3684.3
Cell parameters: 12.546; 25.351; 11.584; 89; 90; 89;  

COD ID: 8101952
CIF file Formula: - C16 H16 B N O6 -
Comments: Li, P.; Liu, Z.-H. Crystal structure of dimethylammonium bis(salicylato)borate, [NH~2~ (CH~3~)~2~][BO~4~(C~7~H~4~O)~2~] Zeitschrift für Kristallographie - New Crystal Structures 221(2) (2006) 179-180
Space group: A b a 2
Cell volume: 1533
Cell parameters: 8.544; 19.679; 9.117; 90; 90; 90;  

COD ID: 8103174
CIF file Formula: - C10 H18 N O4 P -
Comments: Jaeun Kang; Kyungna Jung; Jeesun Ahn; Yeonsun Jung; Seonhong Kim; Yumi Lee; Hoseop Yun; Junghwan Do Crystal structure of 4-phenylbutylammonium dihydrogen phosphate, [C6H5(CH2)4NH3)](H2PO4) Zeitschrift für Kristallographie - New Crystal Structures 226(3) (2011) 423
Space group: A b a 2
Cell volume: 2427.2
Cell parameters: 7.2178; 36.6; 9.1878; 90; 90; 90;  

COD ID: 8104093
CIF file Formula: - Hg2 O7 Te2 -
Comments: Weil, M. Dimorphism in mercury(II) tellurite(IV) tellurate(VI): preparation and crystal structures of alpha- and beta- (Hg2 Te2 O7) Zeitschrift fuer Kristallographie (149,1979-) 218 (2003) 691-698
Space group: A b a 2
Cell volume: 2385.77
Cell parameters: 7.4405; 23.713; 13.522; 90; 90; 90;  


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