Search results

Formula: - F6 H4 Li N Ti -
Comments: Gerasimenko, A.V.; Antokhina, T.F.; Kavun, V.Ya.; Sergienko, V.I. Crystal structure and dynamics of complex ions in the N H4 Li Ti F6 compound, based on X-ray diffraction and nuclear magnetic resonance Zhurnal Neorganicheskoi Khimii 40 (1995) 1463-1465
Space group: P b n a
Cell volume: 985.275
Cell parameters: 12.321; 10.325; 7.745; 90; 90; 90;

COD ID: 1544346
CIF file	Formula: - O3 Rh2 - Comments: Shannon, R.D.; Prewitt, C.T. Synthesis and structure of a new high-pressure form of Rh2O3 Journal of Solid State Chemistry 2 (1970) 134-136 Space group: P b n a Cell volume: 201.45 Cell parameters: 5.1686; 5.3814; 7.2426; 90; 90; 90;

COD ID: 1549446

Formula: - C92 H80 Au4 N16 O13 P4 -
Comments: Illán-Cabeza, Nuria A; García-García, Antonio R; Martínez-Martos, José M; Ramírez-Expósito, María J; Peña-Ruiz, Tomás; Moreno-Carretero, Miguel N A potential antitumor agent, (6-amino-1-methyl-5-nitrosouracilato-N3)-triphenylphosphine-gold(I): structural studies and in vivo biological effects against experimental glioma. European journal of medicinal chemistry 64 (2013) 260-272
Space group: P b n a
Cell volume: 9420
Cell parameters: 17.898; 22.4914; 23.4; 90; 90; 90;

COD ID: 1567940
CIF file	Formula: - In2 O3 - Comments: Yusa, H.; Tsuchiya, T.; Sata, N.; Ohishi, Y. Rh2O3(II)-type structures in Ga2O3 and In2O3 under high pressure: Experiment and theory :In2O3 at 8.1 GPa Physical Review B 77 (2008) 064107-064107 Space group: P b n a Cell volume: 236.942 Cell parameters: 5.432; 5.539; 7.875; 90; 90; 90;

COD ID: 1567941
CIF file	Formula: - Ga2 O3 - Comments: Yusa, H.; Tsuchiya, T.; Sata, N.; Ohishi, Y. Rh2O3(II)-type structures in Ga2O3 and In2O3 under high pressure: Experiment and theory :Ga2O3 at 52 GPa Physical Review B 77 (2008) 064107-064107 Space group: P b n a Cell volume: 159.48 Cell parameters: 4.732; 4.855; 6.942; 90; 90; 90;

COD ID: 2001575
CIF file Original IUCr paper	Formula: - C12 H32 Cl3 Cr N6 O12 - Comments: Beveridge, K. A.; Heyd, D.; Kirk, A. D. Structure of <i>cis</i>-(1,2-ethanediamine)(1,4,8,11-tetraazacyclotetradecane)chromium(III) perchlorate Acta Crystallographica Section C 49(6) (1993) 1063-1066 Space group: P b n a Cell volume: 2456.7 Cell parameters: 12.145; 13.832; 14.624; 90; 90; 90;

COD ID: 2003477
CIF file Original IUCr paper	Formula: - C12 H18 Br N3 O Zn - Comments: Haber, V.; Fábry, J.; Petříček, V. A New Schiff Base Complex: {<i>N</i>-[3-(2-Aminoethylamino)propyl]salicylideneaminato-<i>O</i>,<i>N</i>,<i>N</i>',<i>N</i>''}bromozinc(II) Acta Crystallographica Section C 51(5) (1995) 884-887 Space group: P b n a Cell volume: 2826.8 Cell parameters: 19.951; 7.17; 19.761; 90; 90; 90;

COD ID: 2003655

Formula: - C78 H62 Mn6 N4 O22 -
Comments: Halcrow, M. A.; Streib, W. E.; Folting, K.; Christou, G. [Mn~6~O~2~{O~2~C-3,5-(NO~2~)~2~-C~6~H~3~}~10~(C~5~H~5~N)~2~{(CH~3~)~2~CO}~2~].2(CH~3~)~2~CO.2(C~2~H~5~)~2~O and [Mn~6~O~2~(O~2~CC~6~H~5~)~10~(NCCH~3~)~4~] Acta Crystallographica Section C 51(7) (1995) 1263-1267
Space group: P b n a
Cell volume: 7925
Cell parameters: 18.441; 24.561; 17.497; 90; 90; 90;

COD ID: 2101117

Formula: - C19 H21 N5 O -
Comments: Bannister, C.; Burns, K.; Prout, K.; Watkin, D. J.; Cooper, D. G.; Durant, G. J.; Ganellin, C. R.; Ife, R. J.; Sach, G. S. Structures of histamine H~1~-receptor antagonists derived from the cimetidine group of histamine H~2~-receptor antagonists Acta Crystallographica Section B 50(2) (1994) 221-243
Space group: P b n a
Cell volume: 3507.1
Cell parameters: 7.082; 19.889; 24.899; 90; 90; 90;

COD ID: 2221307

Formula: - C15 H17 Cl N4 S Sn -
Comments: Delgado D., Jorge A.; Okio, Coco K. Y. A.; Welter, Richard (3-Anilino-1-phenyliminothioureato)chloridodimethyltin(IV) Acta Crystallographica Section E 65(4) (2009) m426
Space group: P b n a
Cell volume: 3598.42
Cell parameters: 11.685; 14.892; 20.679; 90; 90; 90;

COD ID: 2224249

Formula: - C14 H12 N2 O2 -
Comments: Basu Baul, Tushar S.; Kundu, Sajal; Arman, Hadi D.; Tiekink, Edward R. T. An orthorhombic polymorph of 5-[(4-methylphenyl)diazenyl]salicylaldehyde Acta Crystallographica Section E 65(12) (2009) o3061
Space group: P b n a
Cell volume: 2312
Cell parameters: 6.016; 14.299; 26.878; 90; 90; 90;

COD ID: 2231718

Formula: - C8 H14 N2 O6 Zn -
Comments: Lee, Ju Eun; Lee, Hong-In catena-Poly[[bis(N,N-dimethylformamide-κO)zinc]-μ~2~-oxalato-κ^4^O^1^,O^2^:O^1'^,O^2'^] Acta Crystallographica Section E 67(9) (2011) m1172
Space group: P b n a
Cell volume: 1179.1
Cell parameters: 7.795; 9.809; 15.421; 90; 90; 90;

COD ID: 2232895

Formula: - C22 H22 Co N2 O4 -
Comments: Perdih, Franc Bis(pentane-2,4-dionato-κ^2^O,O')(1,10-phenanthroline-κ^2^N,N')cobalt(II) Acta Crystallographica Section E 67(12) (2011) m1697
Space group: P b n a
Cell volume: 2032.1
Cell parameters: 10.266; 12.6981; 15.5885; 90; 90; 90;

COD ID: 4021093

Formula: - C18 H22 O4 -
Comments: Sharanjeet K. Bagal; Robert M. Adlington; Jack E. Baldwin; Rodolfo Marquez Dimerization of Butenolide Structures. A Biomimetic Approach to the Dimeric Sesquiterpene Lactones (±)-Biatractylolide and (±)-Biepiasterolide Journal of Organic Chemistry 69 (2004) 9100-9108
Space group: P b n a
Cell volume: 4616.2
Cell parameters: 10.0137; 13.9591; 33.0242; 90; 90; 90;

COD ID: 4037154

Formula: - C23 H25 N3 O2 -
Comments: Pušavec Kirar, Eva; Drev, Miha; Mirnik, Jona; Grošelj, Uroš; Golobič, Amalija; Dahmann, Georg; Požgan, Franc; Štefane, Bogdan; Svete, Jurij Synthesis of 3D-Rich Heterocycles: Hexahydropyrazolo[1,5-a]pyridin-2(1H)-ones and Octahydro-2H-2a,2a1-diazacyclopenta[cd]inden-2-ones. The Journal of organic chemistry 81(19) (2016) 8920-8933
Space group: P b n a
Cell volume: 3914.78
Cell parameters: 10.3267; 16.3628; 23.168; 90; 90; 90;

COD ID: 4080894
CIF file	Formula: - C26 H26 Pt - Comments: Lüning, Anna; Schur, Julia; Hamel, Laura; Ott, Ingo; Klein, Axel Strong Cytotoxicity of Organometallic Platinum Complexes with Alkynyl Ligands Organometallics 32(13) (2013) 3662 Space group: P b n a Cell volume: 1974.5 Cell parameters: 7.9541; 13.085; 18.971; 90; 90; 90;

COD ID: 4082055

Formula: - C42 H54 Cl2 Mo2 O8 P2 -
Comments: Albuerne, Isabel G.; Alvarez, M. Angeles; García, M. Esther; García-Vivó, Daniel; Ruiz, Miguel A. Novel Dimerization of Maleic Anhydride at a Mo2 Complex: Phase-Driven Keto/Enol Tautomerism in a Phosphinidenium‒Ylide Complex Organometallics 32(21) (2013) 6178
Space group: P b n a
Cell volume: 8947.2
Cell parameters: 14.3294; 23.0287; 27.1137; 90; 90; 90;

COD ID: 4085587
CIF file	Formula: - C17 H19 Br Cl3 P - Comments: Schröder, Fabian G.; Sundermeyer, Jörg Fluorenylidene-Functionalized Lithium Phosphonium Di- and Triylides Organometallics 34(6) (2015) 1017-1020 Space group: P b n a Cell volume: 3844.3 Cell parameters: 12.8898; 13.7001; 21.7692; 90; 90; 90;

COD ID: 4086529
CIF file	Formula: - C64 H64 N6 O7 - Comments: Thorp-Greenwood, Flora L.; Pritchard, Victoria E.; Coogan, Michael P.; Hardie, Michaele J. Tris(rheniumfac-tricarbonyl) Polypyridine Functionalized Cyclotriguaiacylene Ligands with Rich and Varied Emission Organometallics 35(11) (2016) 1632 Space group: P b n a Cell volume: 10879 Cell parameters: 9.308; 34.568; 33.811; 90; 90; 90;

COD ID: 4104186
CIF file	Formula: - C36 H60 B Ca N3 O - Comments: Jan Spielmann; Sjoerd Harder Hydrogen Elimination in Bulky Calcium Amidoborane Complexes: Isolation of a Calcium Borylamide Complex Journal of the American Chemical Society 131 (2009) 5064-5065 Space group: P b n a Cell volume: 7381.5 Cell parameters: 16.5823; 17.0572; 26.097; 90; 90; 90;

COD ID: 4105252
CIF file	Formula: - C6 H11 Cl3 O2 - Comments: Christian Nilewski; Roger W. Geisser; Marc-Olivier Ebert; Erick M. Carreira Conformational and Configurational Analysis in the Study and Synthesis of Chlorinated Natural Products Journal of the American Chemical Society 131 (2009) 15866-15876 Space group: P b n a Cell volume: 1941.03 Cell parameters: 10.0179; 10.8181; 17.9104; 90; 90; 90;

COD ID: 4108812

Formula: - C8 H24 Fe4 N6 O4 S4 -
Comments: Chih-Chin Tsou; Zong-Sian Lin; Tsai-Te Lu; Wen-Feng Liaw Transformation of Dinitrosyl Iron Complexes [(NO)2Fe(SR)2]- (R = Et, Ph) into [4Fe-4S] Clusters [Fe4S4(SPh)4]2-: Relevance to the Repair of the Nitric Oxide-Modified Ferredoxin [4Fe-4S] Clusters Journal of the American Chemical Society 130 (2008) 17154-17160
Space group: P b n a
Cell volume: 2229.6
Cell parameters: 10.8158; 12.6567; 16.287; 90; 90; 90;

COD ID: 4111017

Formula: - C46 H46 Cl2 O4 P2 Pd2 -
Comments: F. Albert Cotton; Igor O. Koshevoy; Pascual Lahuerta; Carlos A. Murillo; Mercedes Sanaú; M. Angeles Ubeda; Qinliang Zhao High Yield Syntheses of Stable, Singly Bonded Pd26+ Compounds Journal of the American Chemical Society 128 (2006) 13674-13675
Space group: P b n a
Cell volume: 4258.2
Cell parameters: 11.711; 17.195; 21.146; 90; 90; 90;

COD ID: 4302465

Formula: - C50 H50 N4 Ni3 O10 -
Comments: Pampa Mukherjee; Michael G. B. Drew; Carlos J. Gómez-García; Ashutosh Ghosh The Crucial Role of Polyatomic Anions in Molecular Architecture: Structural And Magnetic Versatility of Five Nickel(II) Complexes Derived from A N,N,O-Donor Schiff Base Ligand Inorganic Chemistry 48 (2009) 5848-5860
Space group: P b n a
Cell volume: 4632.2
Cell parameters: 14.1337; 23.2885; 14.0731; 90; 90; 90;

COD ID: 4319318
CIF file	Formula: - C15 H13 Eu O11 - Comments: Bert D. Alleyne; Avril R. Williams; Lincoln A. Hall; Andrew J. P. White; David J. Williams Lanthanide(III) Methylsquarates: Synthesis and X-ray Structures Inorganic Chemistry 40 (2001) 1045-1051 Space group: P b n a Cell volume: 1742.9 Cell parameters: 8.7129; 13.1148; 15.2529; 90; 90; 90;

COD ID: 4323574
CIF file	Formula: - C14 H14 Ag F3 N2 O3 S - Comments: Lucia Carlucci; Gianfranco Ciani; Dorothea W. v. Gudenberg; Davide M. Proserpio Self-Assembly of Infinite Double Helical and Tubular Coordination Polymers from Ag(CF3SO3) and 1,3-Bis(4-pyridyl)propane Inorganic Chemistry 36 (1997) 3812-3813 Space group: P b n a Cell volume: 3319 Cell parameters: 10.573; 13.533; 23.196; 90; 90; 90;

COD ID: 4327389

Formula: - C23 H21 Fe2 N O7 P2 -
Comments: Pankaj Das; Jean-François Capon; Frédéric Gloaguen; François Y. Pétillon; Philippe Schollhammer; Jean Talarmin; Kenneth W. Muir Di-Iron Aza Diphosphido Complexes: Mimics for the Active Site of Fe-Only Hydrogenase, and Effects of Changing the Coordinating Atoms of the Bridging Ligand in [Fe2{μ-(ECH2)2NR}(CO)6] Inorganic Chemistry 43 (2004) 8203-8205
Space group: P b n a
Cell volume: 5049.62
Cell parameters: 7.9647; 20.4402; 31.0173; 90; 90; 90;

COD ID: 4340282

Formula: - C38.5 H38.75 Br4 N6.25 Ni2 O7 -
Comments: Fondo, Matilde; Ocampo, Noelia; García-Deibe, Ana M; Vicente, Ramón; Corbella, Montserrat; Bermejo, Manuel R.; Sanmartín, Jesús Self-assembly of a tetranuclear Ni4 cluster with an S = 4 ground state: the first 3d metal cluster bearing a mu4-eta2:eta2-O,O carbonate ligand. Inorganic chemistry 45(1) (2006) 255-262
Space group: P b n a
Cell volume: 8713.5
Cell parameters: 14.616; 24.349; 24.4841; 90; 90; 90;

COD ID: 4342867

Formula: - C58 H48 Dy F9 N4 O6 S9 -
Comments: Pointillart, Fabrice; Jung, Julie; Berraud-Pache, Romain; Le Guennic, Boris; Dorcet, Vincent; Golhen, Stéphane; Cador, Olivier; Maury, Olivier; Guyot, Yannick; Decurtins, Silvio; Liu, Shi-Xia; Ouahab, Lahcène Luminescence and single-molecule magnet behavior in lanthanide complexes involving a tetrathiafulvalene-fused dipyridophenazine ligand. Inorganic chemistry 54(11) (2015) 5384-5397
Space group: P b n a
Cell volume: 13961.5
Cell parameters: 19.4111; 20.991; 34.2648; 90; 90; 90;

COD ID: 4507044
CIF file	Formula: - C13 H14 N2 O4 - Comments: Stilinović, Vladimir; Kaitner, Branko Salts and Co-Crystals of Gentisic Acid with Pyridine Derivatives: The Effect of Proton Transfer on the Crystal Packing (and Vice Versa) Crystal Growth & Design 12(11) (2012) 5763 Space group: P b n a Cell volume: 5204.5 Cell parameters: 9.5162; 23.3861; 23.3861; 90; 90; 90;

COD ID: 4513212
CIF file	Formula: - C20 H28 N4 O - Comments: Erer, Hakan; Yeşilel, Okan Zafer; Arıcı, Mürsel A Series of Zinc(II) 3D →3D Interpenetrated Coordination Polymers Based On Thiophene-2,5-dicarboxylate and Bis(Imidazole) Derivative Linkers Crystal Growth & Design 15(7) (2015) 3201 Space group: P b n a Cell volume: 2002.43 Cell parameters: 11.686; 11.971; 14.314; 90; 90; 90;

COD ID: 7003795
CIF file	Formula: - C17 H7 B Br2 F10 N2 - Comments: Vidovic, Dragoslav; Reeske, Gregor; Findlater, Michael; Cowley, Alan H. Synthesis and structures of boron dihalides supported by the C6F5-substituted β-diketiminate ligand [HC(CMe)2(NC6F5)2]− Dalton Transactions (issue 17) (2008) 2293-2297 Space group: P b n a Cell volume: 1897.6 Cell parameters: 7.457; 11.566; 22.002; 90; 90; 90;

COD ID: 7009049

Formula: - C12 H21 N5 O Sn -
Comments: Bhandari, Sonali; Frost, Christopher G.; Hague, Catherine E.; Mahon, Mary F.; Molloy, Kieran C. Synthesis of functionalised (triorganostannyl)tetrazoles: supramolecular structures of n-[2-(triorganostannyl)tetrazol-5-yl]pyridine (n = 2, 3 or 4)† Journal of the Chemical Society, Dalton Transactions (issue 5) (2000) 663
Space group: P b n a
Cell volume: 3301.6
Cell parameters: 13.781; 14.764; 16.227; 90; 90; 90;

COD ID: 7012672

Formula: - C30 H42 Cl6 Hg3 N14 -
Comments: Bebout, Deborah C.; Garland, Melissa M.; Murphy, Geoffrey S.; Bowers, Edith V.; Abelt, Christopher J.; Butcher, Raymond J. Investigation of the mercury(ii) coordination chemistry of tris[(1-methylimidazol-2-yl)methyl]amine by X-ray crystallography and NMRElectronic supplementary information (ESI) available: Cell packing diagrams for 1?3 and NMR figures showing trends in chemical shift as a function of [Hg(ii)]/1 for both Hg(ClO4)2 and HgCl2. See http://www.rsc.org/suppdata/dt/b3/b300001j/ Dalton Transactions (issue 12) (2003) 2578
Space group: P b n a
Cell volume: 4212
Cell parameters: 9.093; 15.381; 30.119; 90; 90; 90;

COD ID: 7015588

Formula: - C13 H24 F3 N O2 -
Comments: Yang, Pei-Pei; Wang, Xiao-Ling; Li, Li-Cun; Liao, Dai-Zheng Synthesis, structure and magnetic properties of a novel family of heterometallic nonanuclear Na(I)2Mn(III)6Ln(III) (Ln = Eu, Gd, Tb, Dy) complexes. Dalton transactions (Cambridge, England : 2003) 40(16) (2011) 4155-4161
Space group: P b n a
Cell volume: 2988.63
Cell parameters: 12.284; 13.229; 18.391; 90; 90; 90;

COD ID: 7016074
CIF file	Formula: - C37 H60 B Ca N3 O - Comments: Hill, Michael S.; Hodgson, Marina; Liptrot, David J.; Mahon, Mary F. Stoichiometric reactivity of dialkylamine boranes with alkaline earth silylamides. Dalton transactions (Cambridge, England : 2003) 40(30) (2011) 7783-7790 Space group: P b n a Cell volume: 7448.8 Cell parameters: 16.784; 16.837; 26.359; 90; 90; 90;

COD ID: 7035772

Formula: - C16.5 H15.5 Bi N1.5 O6.5 -
Comments: Burrows, Andrew D.; Jurcic, Monika; Mahon, Mary F.; Pierrat, Sandrine; Roffe, Gavin W.; Windle, Henry J.; Spencer, John Bismuth coordination networks containing deferiprone: synthesis, characterisation, stability and antibacterial activity. Dalton transactions (Cambridge, England : 2003) 44(31) (2015) 13814-13817
Space group: P b n a
Cell volume: 3191.67
Cell parameters: 7.135; 19.239; 23.251; 90; 90; 90;

COD ID: 7050231

Formula: - C9 H8 Br N O Se -
Comments: Kumar, Sangit; Kandasamy, Karuppasamy; Singh, Harkesh B.; Butcher, Ray J. Synthesis of organochalcogens stabilized by intramolecular non-bonded interactions of sterically unhindered 2-phenyl-2-oxazolineElectronic supplementary information (ESI) available: 77Se NMR spectrum of 14, molecular structure of 16 and packing diagram of 15. See http://www.rsc.org/suppdata/nj/b3/b312364b/ New Journal of Chemistry 28(5) (2004) 640
Space group: P b n a
Cell volume: 1925.9
Cell parameters: 7.3118; 15.2642; 17.2559; 90; 90; 90;

COD ID: 7054059

Formula: - C69 H86 Fe6 N48 O25 S6 -
Comments: Abhervé, Alexandre; Clemente-Juan, Juan Modesto; Clemente-León, Miguel; Coronado, Eugenio; Boonmak, Jaursup; Youngme, Sujittra Tuning the nuclearity of iron(iii) polynuclear clusters by using tetradentate Schiff-base ligands New Journal of Chemistry 38(5) (2014) 2105
Space group: P b n a
Cell volume: 10701.1
Cell parameters: 15.5153; 25.855; 26.6761; 90; 90; 90;

COD ID: 7054702
CIF file	Formula: - C18 H16 N2 O2 S - Comments: Salahifar, Eslam; Nematollahi, Davood Electrochemical generation of a Michael acceptor: a green method for the synthesis of 4-amino-3-(phenylsulfonyl)diphenylamine derivatives New J. Chem. 39(5) (2015) 3852 Space group: P b n a Cell volume: 3264.2 Cell parameters: 7.4296; 19.375; 22.676; 90; 90; 90;

COD ID: 7058890

Formula: - C70 H79 Cd Cl2 N5 O4 -
Comments: Yue, Liu-Juan; Liu, Ying-Ying; Xu, Guo-Hai; Ma, Jian-Fang Calix[4]arene-based polyoxometalate organic‒inorganic hybrid and coordination polymer as heterogeneous catalysts for azide‒alkyne cycloaddition and Knoevenagel condensation reaction New Journal of Chemistry 43(40) (2019) 15871
Space group: P b n a
Cell volume: 13701.2
Cell parameters: 13.1543; 24.637; 42.2769; 90; 90; 90;

COD ID: 7104785

Formula: - C35 H41 N3 Yb -
Comments: Kuehl, Christopher J.; Da Re, Ryan E.; Scott, Brian L.; Morris, David E.; John, Kevin D. Toward new paradigms in mixed-valency: ytterbocene‒terpyridine charge-transfer complexes Chemical Communications (Cambridge, United Kingdom) (issue 18) (2003) 2336-2337
Space group: P b n a
Cell volume: 2966
Cell parameters: 14.214; 14.214; 14.682; 90; 90; 90;

COD ID: 7105214

Formula: - C12 H32 Cl4 O10 Th -
Comments: Cantat, Thibault; Scott, Brian L.; Kiplinger, Jaqueline L. Convenient access to the anhydrous thorium tetrachloride complexes ThCl(4)(DME)(2), ThCl(4)(1,4-dioxane)(2) and ThCl(4)(THF)(3.5) using commercially available and inexpensive starting materials. Chemical communications (Cambridge, England) 46(6) (2010) 919-921
Space group: P b n a
Cell volume: 2359.9
Cell parameters: 10.2963; 12.3952; 18.491; 90; 90; 90;

COD ID: 7115508
CIF file	Formula: - C21 H31 Cl Cr N2 - Comments: Wen Zhou; Brian O. Patrick; Kevin M. Smith Influence of redox non-innocent phenylenediamido ligands on chromium imido hydrogen-atom abstraction reactivity Chem.Commun. 50 (2014) 9958 Space group: P b n a Cell volume: 4185.4 Cell parameters: 13.5642; 16.8668; 18.294; 90; 90; 90;

COD ID: 7203957

Formula: - C9 H18 O2 -
Comments: Johnston, Derek; McCusker, Catherine F.; Muir, Kenneth; Procter, David J. Samarium(II)-mediated 4-exo-trig cyclisations of unsaturated aldehydes. A stereoselective approach to functionalised cyclobutanols Journal of the Chemical Society, Perkin Transactions 1 (issue 5) (2000) 681
Space group: P b n a
Cell volume: 1861.8
Cell parameters: 8.254; 11.229; 20.088; 90; 90; 90;

COD ID: 7205542

Formula: - C13 H24 F3 N O2 -
Comments: Belhocine, Tayeb; Forsyth, Stewart A.; Gunaratne, H. Q. Nimal; Nieuwenhuyzen, Mark; Puga, Alberto V.; Seddon, Kenneth R.; Srinivasan, Geetha; Whiston, Keith New ionic liquids from azepane and 3-methylpiperidine exhibiting wide electrochemical windows Green Chemistry 13(1) (2011) 59
Space group: P b n a
Cell volume: 2988.63
Cell parameters: 12.284; 13.229; 18.391; 90; 90; 90;

COD ID: 7207997
CIF file	Formula: - C16 H48 I5 O8 S8 Tb - Comments: Mishra, Shashank; Jeanneau, Erwann; Ledoux, Gilles; Daniele, Stéphane Solid-state structural transformations in metal organic-inorganic hybrids constructed from terbium(iii) complexes and iodocuprate clusters CrystEngComm 14(11) (2012) 3894 Space group: P b n a Cell volume: 4426.3 Cell parameters: 19.474; 18.597; 12.222; 90; 90; 90;

COD ID: 7214772
CIF file	Formula: - C24 H22 Cl2 Hg N6 O4 - Comments: Khavasi, Hamid Reza; Barforoush, Maryam Mehdizadeh; Fard, Mahmood Azizpoor Influence of ligand substituent on structural assembly and coordination geometry CrystEngComm 14(21) (2012) 7236 Space group: P b n a Cell volume: 2502.4 Cell parameters: 6.7123; 13.9195; 26.783; 90; 90; 90;

COD ID: 7221635

Formula: - C22 H26 N4 S2 -
Comments: Belikov, Mikhail Yu; Fedoseev, Sergey V.; Ievlev, Mikhail Yu; Ershov, Oleg V.; Tafeenko, Viktor Interaction of 4-oxoalkane-1,1,2,2-tetracarbonitriles with Lawesson's reagent ‒ a new approach to the synthesis of 2,2'-disulfanediylbis(1H-pyrroles). The synthesis of photochromic diarylethene with disulfide bridge RSC Adv. (2015)
Space group: P b n a
Cell volume: 2172.81
Cell parameters: 9.6655; 13.8908; 16.1834; 90; 90; 90;

COD ID: 7233750
CIF file	Formula: - C15 H11 - Comments: Hua Wang; Yan Liang; Huanling Xie; Linglong Feng; Haifeng Lu; Shengyu Feng Emission enhancement and color adjustment of silicon-cored structure in tetraphenyl benzene with aggregation-enhanced emission Journal of Materials Chemistry C 2 (2014) 5601-5606 Space group: P b n a Cell volume: 2114.1 Cell parameters: 9.007; 9.991; 23.493; 90; 90; 90;

COD ID: 9000214
CIF file	Formula: - Fe3 H3 O11 P2 - Comments: Moore, P. B. The Fe3(H2O)n(PO4)2 homologous series: Crystal-chemical relationships and oxidized equivalents American Mineralogist 56 (1971) 1-17 Space group: P b n a Cell volume: 800.558 Cell parameters: 9.404; 9.973; 8.536; 90; 90; 90;

COD ID: 9009459
CIF file	Formula: - Fe H6 Mn2 O11 P2 - Comments: Moore, P. B.; Araki, T.; Kampf, A. R. Nomenclature of the phosphoferrite structure type: refinements of landesite and kryzhanovskite Mineralogical Magazine 43 (1980) 789-795 Space group: P b n a Cell volume: 822.945 Cell parameters: 9.458; 10.185; 8.543; 90; 90; 90;

COD ID: 9009460
CIF file	Formula: - Fe2 H6 Mn O11 P2 - Comments: Moore, P. B.; Araki, T.; Kampf, A. R. Nomenclature of the phosphoferrite structure type: refinements of landesite and kryzhanovskite Mineralogical Magazine 43 (1980) 789-795 Space group: P b n a Cell volume: 773.92 Cell parameters: 9.45; 10.013; 8.179; 90; 90; 90;

COD ID: 9009798
CIF file	Formula: - Ca H O3.5 S - Comments: Schropfer, L. Strukturelle untersuchungen an CaSO31/2H2O Locality: synthetic Zeitschrift fur Anorganische und Allgemeine Chemie 401 (1973) 1-14 Space group: P b n a Cell volume: 678.447 Cell parameters*: 6.4844; 9.8123; 10.6629; 90; 90; 90;

COD ID: 9013466
CIF file	Formula: - Fe3 H6 O11 P2 - Comments: Moore, P. B.; Araki, T. A mixed-valence solid-solution series: Crystal structures of phosphoferrite, Fe3(H2O)3[PO4]2, and kryzhanovskite, Fe3(OH)3[PO4]2 Inorganic Chemistry 15 (1976) 316-321 Space group: P b n a Cell volume: 822.15 Cell parameters: 9.46; 10.024; 8.67; 90; 90; 90;

COD ID: 9013467

Formula: - Fe3 H3 O11 P2 -
Comments: Moore, P. B.; Araki, T. A mixed-valence solid-solution series: Crystal structures of phosphoferrite, Fe3(H2O)3[PO4]2, and kryzhanovskite, Fe3(OH)3[PO4]2 Note: this sample was synthesized by heating phosphoferrite in air Inorganic Chemistry 15 (1976) 316-321
Space group: P b n a
Cell volume: 745.204
Cell parameters: 9.518; 9.749; 8.031; 90; 90; 90;

COD ID: 9017049