Search results

Formula: - Fe1.15 Ga0.85 O3 -
Comments: Bertaut, E F; Bassi, G; Buisson, G; Chappert, J; Delapalme, A; Pauthenet, R; Rebouillat, H P; Aleonard, R Etude par effet Moessbauer, rayons X, diffraction neutronique et mesures magnetiques de Fe1.15 Ga.85 O3 Journal de Physique (Paris) 27 (1966) 433-448
Space group: P c 21 n
Cell volume: 417
Cell parameters: 8.75; 9.4; 5.07; 90; 90; 90;

COD ID: 1009028
CIF file	Formula: - H15 Li N5 O3 - Comments: Klein, W M; Jansen, M Darstellung und Kristallstruktur von LithiumozonidAmmoniakat (1/5) (Li O3) 5(N H3) Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-) 54 (1999) 1345-1349 Space group: P c 21 n Cell volume: 867.5 Cell parameters: 12.319; 6.374; 11.048; 90; 90; 90;

COD ID: 1511494
CIF file	Formula: - B4 Nd2 O12 Sr3 - Comments: Abdullaev, G.K.; Mamedov, Kh.S. The refinement of the crystal structure of Nd2 Sr3 (B O3)4 Kristallografiya 27 (1982) 795-797 Space group: P c 21 n Cell volume: 1050.31 Cell parameters: 8.791; 16.176; 7.386; 90; 90; 90;

COD ID: 1511734
CIF file	Formula: - B4 Er2 O12 Sr3 - Comments: Mamedov, C.; Abdullaev, G.K. Kristallicheskaya struktura dboinogo ortoborata erbyia istrontsiya Er2 Sr3 (B O3)4 Zhurnal Strukturnoi Khimii (Issue-No. from 1981) 17 (1976) 188-191 Space group: P c 21 n Cell volume: 977.631 Cell parameters: 8.57; 15.8; 7.22; 90; 90; 90;

COD ID: 1511758
CIF file	Formula: - B4 La2 O12 Sr3 - Comments: Mamedov, Kh.S.; Abdullaev, G.K.; Amirov, S.T. Crystal structure of La2 Sr3 (B O3)4 Kristallografiya 18 (1973) 1075-1077 Space group: P c 21 n Cell volume: 1077.54 Cell parameters: 8.78; 16.54; 7.42; 90; 90; 90;

COD ID: 1521814
CIF file	Formula: - C48 H64 Al32 N4 O132 P32 - Comments: Ramaswamy, V.; McCusker, L.B.; Baerlocher, C. Rietveld refinement of the pure aluminophosphate (Al P O4)-40 Microporous and Mesoporous Materials 31 (1999) 1-8 Space group: P c 21 n Cell volume: 4246.08 Cell parameters: 21.75099; 13.73; 14.218; 90; 90; 90;

COD ID: 1526309
CIF file	Formula: - Bi Cd O5 V - Comments: Radosavljevic, I.; Sleight, A.W.; Howard, J.A.K. Synthesis and structure of two new bismuth cadmium vanadates, Bi Cd V O5 and Bi Cd2 V O6, and structures of Bi Ca2 As O6 and Bi Mg2 P O6 International Journal of Inorganic Materials 2 (2000) 543-550 Space group: P c 21 n Cell volume: 919.417 Cell parameters: 5.505; 11.699; 14.276; 90; 90; 90;

COD ID: 1529983
CIF file	Formula: - Hg I3 K - Comments: Gerken, V.A.; Pakhomov, V.I. Roentgenographical study of crystals in system K I-Hg I2-H2 O Zhurnal Strukturnoi Khimii (Issue-No. from 1981) 10 (1969) 753-754 Space group: P c 21 n Cell volume: 936.017 Cell parameters: 9.35; 11.52; 8.69; 90; 90; 90;

COD ID: 1530408
CIF file	Formula: - Na O4 Si Y - Comments: Merinov, B.V.; Ilyukhin, V.V.; Maksimov, B.A.; Belov, N.V. The refinement of the crystal structure of Na, Y-orthosilicate Na Y Si O4 Doklady Akademii Nauk SSSR 248 (1979) 1108-1111 Space group: P c 21 n Cell volume: 365.042 Cell parameters: 5.128; 6.393; 11.135; 90; 90; 90;

COD ID: 1534839
CIF file	Formula: - O5 P Rb Ti - Comments: Lyakhov, A.S.; Selevich, A.F.; Verenich, A.I. Crystal structure of rubidium titanilphosphate alpha RbTiOPO4 Zhurnal Neorganicheskoi Khimii 38 (1993) 1121-1124 Space group: P c 21 n Cell volume: 896.31 Cell parameters: 6.518; 10.582; 12.995; 90; 90; 90;

COD ID: 1534942
CIF file	Formula: - Cr F K O4 P - Comments: Slobodyanik, N.S.; Nagornyi, P.G.; Kornienko, Z.I.; Kapshuk, A.A. Crystal structure of fluorophosphate KCrPO4F. Zhurnal Neorganicheskoi Khimii 36 (1991) 1390-1392 Space group: P c 21 n Cell volume: 855.762 Cell parameters: 6.346; 10.555; 12.776; 90; 90; 90;

COD ID: 1536126
CIF file	Formula: - Br4 Rb2 Zn - Comments: Novikova, M.S.; Tamazyan, R.A.; Simonov, V.I. X-ray structural study of a high temperature modification of Rb2 Zn Br4, T= 368 K Kristallografiya 36 (1991) 1380-1387 Space group: P c 21 n Cell volume: 997.811 Cell parameters: 13.38; 7.666; 9.728; 90; 90; 90;

COD ID: 1536839
CIF file	Formula: - H2 N5 O10.5 Pb Ru - Comments: Kokunova, V.N.; Stash, A. Crystal structure of Pb (Ru N O (N O2)4 O H) . 0.5(H2 O) Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)) 20 (1994) 862-865 Space group: P c 21 n Cell volume: 1089.45 Cell parameters: 10.403; 7.512; 13.941; 90; 90; 90;

COD ID: 1541747
CIF file	Formula: - Al3 H15 O17 P2 - Comments: Fu, P.Q. The crystal structure of wavellite Ti Chih Ko Hsueh (= Scientia Geologica Sinica) 2 (1966) 116-135 Space group: P c 21 n Cell volume: 1155.62 Cell parameters: 9.57; 17.3; 6.98; 90; 90; 90;

COD ID: 2003898
CIF file Original IUCr paper	Formula: - C14 H12 N2 O2 - Comments: Lyubchova, A.; Cossé-Barbi, A.; Doucet, J. P.; Robert, F.; Souron, J.-P.; Quarton, M. Salicylaldehyde Benzoyl Hydrazone Acta Crystallographica Section C 51(9) (1995) 1893-1895 Space group: P c 21 n Cell volume: 1163.6 Cell parameters: 5.114; 10.896; 20.883; 90; 90; 90;

COD ID: 2105981

Formula: - C9 H23 Br2 Ca N3 O7 -
Comments: Lamberts, Kevin; Möller, Andreas; Englert, Ulli Enantiopure and racemic alanine as bridging ligands in Ca and Mn chain polymers Acta Crystallographica Section B 70(6) (2014) 989-998
Space group: P c 21 n
Cell volume: 1811.1
Cell parameters: 4.8727; 16.0701; 23.129; 90; 90; 90;

COD ID: 2106186
CIF file	Formula: - Cu3 H7 N O6 P2 - Comments: Declercq, J.P.; Piret, P.; Germain, G. Composition et structure de la likasite, Cu3 P2 H3 (N O3) (O H)2 (H2 O) Acta Crystallographica B (24,1968-38,1982) 33 (1977) 1422-1427 Space group: P c 21 n Cell volume: 855.665 Cell parameters: 5.828; 6.769; 21.69; 90; 90; 90;

COD ID: 2202949

Formula: - C27 H22 Cr O7 -
Comments: Hansen, Lars Kr. Pentacarbonyl[ethoxy(2-ethoxy-4,5-diphenyl-1,3-cyclopentadienyl)carbene]chromium(0) Acta Crystallographica Section E 59(9) (2003) m703-m704
Space group: P c 21 n
Cell volume: 2517.9
Cell parameters: 10.174; 12.653; 19.559; 90; 90; 90;

COD ID: 2222978

Formula: - As2 K1.642 O10 V1.78 W0.22 -
Comments: Belkhiri, Sabrina; Kars, Mohammed; Mezaoui, Djillali K~1.65~V~1.78~W~0.22~O~2~(AsO~4~)~2~ Acta Crystallographica Section E 65(9) (2009) i69
Space group: P c 21 n
Cell volume: 916.04
Cell parameters: 6.5322; 10.7228; 13.0782; 90; 90; 90;

COD ID: 2235598

Formula: - As2 K2 O10 V2 -
Comments: Belkhiri, Sabrina; Mezaoui, Djillali; Roisnel, Thierry K~2~V~2~O~2~(AsO~4~)~2~ Acta Crystallographica Section E 68(7) (2012) i54
Space group: P c 21 n
Cell volume: 915.87
Cell parameters: 6.5368; 10.7228; 13.0666; 90; 90; 90;

COD ID: 2310616
CIF file	Formula: - Cd O3 Ti - Comments: Kay, H.F.; Miles, J.L. The Structure of Cadmium Titanate and Sodium Tantalate Acta Crystallographica (1,1948-23,1967) 10 (1957) 213-218 Space group: P c 21 n Cell volume: 220.607 Cell parameters: 5.348; 7.615; 5.417; 90; 90; 90;

COD ID: 2310617
CIF file	Formula: - Na O3 Ta - Comments: Kay, H.F.; Miles, J.L. The structure of cadmium titanate and sodium tantalate Acta Crystallographica (1,1948-23,1967) 10 (1957) 213-218 Space group: P c 21 n Cell volume: 234.764 Cell parameters: 5.4941; 7.7508; 5.513; 90; 90; 90;

COD ID: 4000209
CIF file	Formula: - C18 H20 Cd F12 O8 - Comments: Chemistry of Materials (2002) Space group: P c 21 n Cell volume: 2724.5 Cell parameters: 11.694; 14.972; 15.561; 90; 90; 90;

COD ID: 4020813

Formula: - C21 H28 N4 O7 -
Comments: Alexandru T. Balaban; Ion Ghiviriga; Edmund W. Czerwinski; Priyadarsi De; Rudolf Faust Simple Synthesis of a Weak Nucleophilic Base (4-Ethyl-2,6-diisopropyl-3,5-dimethylpyridine) Evidencing a Double Janus Group Effect Journal of Organic Chemistry 69 (2004) 536-542
Space group: P c 21 n
Cell volume: 2265.4
Cell parameters: 8.969; 12.185; 20.729; 90; 90; 90;

COD ID: 4020814

Formula: - C15 H25 F6 O P -
Comments: Alexandru T. Balaban; Ion Ghiviriga; Edmund W. Czerwinski; Priyadarsi De; Rudolf Faust Simple Synthesis of a Weak Nucleophilic Base (4-Ethyl-2,6-diisopropyl-3,5-dimethylpyridine) Evidencing a Double Janus Group Effect Journal of Organic Chemistry 69 (2004) 536-542
Space group: P c 21 n
Cell volume: 1717.88
Cell parameters: 8.3587; 13.4737; 15.2534; 90; 90; 90;

COD ID: 4021045

Formula: - C10 H16 O3 -
Comments: David M. Hodgson; Frédéric Le Strat; Thomas D. Avery; Andrew C. Donohue; Tobias Brückl Stereocontrolled Syntheses of the Nemorensic Acids Using 6-Diazoheptane-2,5-dione in Carbonyl Ylide Cycloadditions Journal of Organic Chemistry 69 (2004) 8796-8803
Space group: P c 21 n
Cell volume: 978.6
Cell parameters: 7.2339; 7.5773; 17.8539; 90; 90; 90;

COD ID: 4027062
CIF file	Formula: - C15 H13 N O S - Comments: Arnab Kumar Maity; Sujit Roy A Multimetallic Piano-Stool Ir-Sn3 Catalyst for Nucleophilic Substitution Reaction of γ-Hydroxy Lactams through N-Acyliminium Ions Journal of Organic Chemistry 77 (2012) 2935-2941 Space group: P c 21 n Cell volume: 1308.3 Cell parameters: 5.985; 7.913; 27.626; 90; 90; 90;

COD ID: 4028897

Formula: - C18 H18 N2 O6 S -
Comments: Declerck, Valérie; Allouchi, Hassan; Martinez, Jean; Lamaty, Frédéric 2-Trimethylsilylethanesulfonyl (SES) versus Tosyl (Ts) Protecting Group in the Preparation of Nitrogen-Containing Five-Membered Rings. A Novel Route for the Synthesis of Substituted Pyrrolines and Pyrrolidines The Journal of Organic Chemistry 72(4) (2007) 1518-1521
Space group: P c 21 n
Cell volume: 3580.4
Cell parameters: 7.5353; 21.1912; 22.4218; 90; 90; 90;

COD ID: 4030497

Formula: - C12 H30 B20 -
Comments: Johnson, S. E.; Gomez, F. A.; Hawthorne, M. F.; Thorne, K. J.; Mackenzie, J. D. organofunctionalized derivatives of alpha-carborane as molecular precursors to non-oxide ceramics of boron European Journal of Solid State and Inorganic Chemistry 29(Supp) (1992) 113-125
Space group: P c 21 n
Cell volume: 2312.7
Cell parameters: 6.7064; 11.229; 30.71; 90; 90; 90;

COD ID: 4034555
CIF file	Formula: - C19 H19 N2 O3 - Comments: Zhang, Jing; Han, Fu-She A Total Synthesis of (±)-Leuconodines D and E. The Journal of organic chemistry 84(21) (2019) 13890-13896 Space group: P c 21 n Cell volume: 1582.66 Cell parameters: 7.4919; 13.2055; 15.9971; 90; 90; 90;

COD ID: 4036973

Formula: - C12 H16 I N O -
Comments: Davies, Stephen G.; Figuccia, Aude L. A.; Fletcher Paul, Ai M.; Roberts, M.; Thomson, James E. Asymmetric Syntheses of (-)-ADMJ and (+)-ADANJ: 2-Deoxy-2-amino Analogues of (-)-1-Deoxymannojirimycin and (+)-1-Deoxyallonojirimycin. The Journal of organic chemistry 81(15) (2016) 6481-6495
Space group: P c 21 n
Cell volume: 2480.85
Cell parameters: 9.9626; 14.5776; 17.0821; 90; 90; 90;

COD ID: 4060702
CIF file	Formula: - C51 H56 N4 O5 Ru - Comments: Organometallics (2003) Space group: P c 21 n Cell volume: 9276.04 Cell parameters: 14.6284; 18.9827; 33.4047; 90; 90; 90;

COD ID: 4062814
CIF file	Formula: - C47 H52 Cl F3 O3 P2 Ru S - Comments: Jess R. Berenguer; Mara Bernechea; Juan Fornis; Ana Garca; Elena Lalinde (p-cymene)Ruthenium(II)(diphenylphosphino)alkyne Complexes: Preparation of (m-Cl)(m-PPh2CCR) Bridged Ru/Pt Heterobimetallic Complexes. Organometallics (2004) Space group: P c 21 n Cell volume: 4550.82 Cell parameters: 15.5177; 16.831; 17.4242; 90; 90; 90;

COD ID: 4064738

Formula: - C30 H105 B33 Co N9 O2 Sn3 -
Comments: Fleischhauer, Sebastian; Eichele, Klaus; Schellenberg, Inga; Pöttgen, Rainer; Wesemann, Lars Cobalt, Rhodium, Iridium, and Ruthenium Carbonyl Complexes with Stanna-closo-dodecaborate:103Rh NMR,119Sn Mössbauer Spectroscopy, and Solid-State119Sn NMR Organometallics 30(11) (2011) 3200
Space group: P c 21 n
Cell volume: 7057.1
Cell parameters: 12.4299; 17.8892; 31.737; 90; 90; 90;

COD ID: 4067906

Formula: - C14 H14 Cl F12 In N2 O2 -
Comments: Normand, Mickael; Kirillov, Evgeny; Roisnel, Thierry; Carpentier, Jean-François Indium Complexes of Fluorinated Dialkoxy-Diimino Salen-like Ligands for Ring-Opening Polymerization ofrac-Lactide: How Does Indium Compare to Aluminum? Organometallics 31(4) (2012) 1448
Space group: P c 21 n
Cell volume: 2063.11
Cell parameters: 11.1319; 12.4006; 14.9455; 90; 90; 90;

COD ID: 4068868
CIF file	Formula: - C26 H36 Cl N2 Nb O2 - Comments: Despagnet-Ayoub, Emmanuelle; Schigand, Sophie; Vendier, Laure; Etienne, Michel Amine−Phenolate Ligands in Niobium Chemistry: π-Interactions Probed by an Ancillary Alkyne Ligand Organometallics 28(7) (2009) 2188 Space group: P c 21 n Cell volume: 2595.7 Cell parameters: 12.069; 14.3034; 15.0363; 90; 90; 90;

COD ID: 4074368
CIF file	Formula: - C30 H54 N6 O2 Ti - Comments: Lee, Alison V.; Schafer, Laurel L. Group 4 Bis(pyrimidinoxide) Complexes. Investigations of Electronic Effects in Catalytic Hydroamination Organometallics 25(22) (2006) 5249 Space group: P c 21 n Cell volume: 3360.6 Cell parameters: 10.571; 17.7226; 17.9379; 90; 90; 90;

COD ID: 4114421

Formula: - C6 H22 B18 Co Cs -
Comments: Isabel Rojo; Francesc Teixidor; Raikko Kivekäs; Reijo Sillanpää; Clara Viñas Formation of Bridging Alkene and Conjugated Dialkenes Exclusively Generated from Alkynes on the [3,3'-Co(1,2-C~2~B~9~H~11~)~2~]^-^ Platform. The Unique Hydroboration Role of [3,3'-Co(1,2-C~2~B~9~H~11~)~2~]^-^ Journal of the American Chemical Society 125 (2003) 14720-14721
Space group: P c 21 n
Cell volume: 1864.26
Cell parameters: 7.1731; 9.5405; 27.2413; 90; 90; 90;

COD ID: 4116421
CIF file	Formula: - C25 H51 B12 N3 - Comments: Toralf Peymann; Carolyn B. Knobler; M. Frederick Hawthorne An Icosahedral Array of Methyl Groups Supported by an Aromatic Borane Scaffold: The [closo-B12(CH3)12]2- Ion Journal of the American Chemical Society 121 (1999) 5601-5602 Space group: P c 21 n Cell volume: 3337 Cell parameters: 9.715; 15.052; 22.819; 90; 90; 90;

COD ID: 4117748

Formula: - C16 H17 Br O3 -
Comments: Francis Beaumier; Marianne Dupuis; Claude Spino; Claude Y. Legault Formal Intramolecular (4 + 1)-Cycloaddition of Dialkoxycarbenes: Control of the Stereoselectivity and a Mechanistic Portrait Journal of the American Chemical Society 134 (2012) 5938-5953
Space group: P c 21 n
Cell volume: 2869.4
Cell parameters: 12.034; 15.092; 15.799; 90; 90; 90;

COD ID: 4311444
CIF file	Formula: - C12 H18 Co I2 N6 S3 - Comments: Christopher A. Dodds; Mario-Alexander Lehmann; Jonathan F. Ojo; John Reglinski; Mark D. Spicer Cobalt Half-Sandwich, Sandwich, and Mixed Sandwich Complexes with Soft Tripodal Ligands Inorganic Chemistry 43 (2004) 4927-4934 Space group: P c 21 n Cell volume: 2174.7 Cell parameters: 11.302; 16.167; 11.902; 90; 90; 90;

COD ID: 4314614
CIF file	Formula: - C21 H20 Fe N6 S2 - Comments: Bao Li; Rong-Jia Wei; Jun Tao; Rong-Bin Huang; Lan-Sun Zheng Pressure Effects on a Spin-Crossover Monomeric Compound [Fe(pmea)(SCN)2] (pmea = bis[(2-pyridyl)methyl]-2-(2-pyridyl)ethylamine) Inorganic Chemistry 49 (2010) 745-751 Space group: P c 21 n Cell volume: 2263.8 Cell parameters: 10.8278; 13.653; 15.313; 90; 90; 90;

COD ID: 4314615
CIF file	Formula: - C21 H20 Fe N6 S2 - Comments: Bao Li; Rong-Jia Wei; Jun Tao; Rong-Bin Huang; Lan-Sun Zheng Pressure Effects on a Spin-Crossover Monomeric Compound [Fe(pmea)(SCN)2] (pmea = bis[(2-pyridyl)methyl]-2-(2-pyridyl)ethylamine) Inorganic Chemistry 49 (2010) 745-751 Space group: P c 21 n Cell volume: 2085.72 Cell parameters: 10.4506; 13.3129; 14.9914; 90; 90; 90;

COD ID: 4316811
CIF file	Formula: - C30 H19 F3 N6 O9 Re2 S - Comments: Eva Gómez; Miguel Ángel Huertos; Julio Pérez; Lucía Riera; Amador Menéndez-Velázquez Organometallic Complexes with Terminal Imidazolato Ligands and Their Use as Metalloligands Inorganic Chemistry 49 (2010) 9527-9534 Space group: P c 21 n Cell volume: 3284.39 Cell parameters: 18.978; 10.373; 16.684; 90; 90; 90;

COD ID: 4319392
CIF file	Formula: - C25 H51 B12 N3 - Comments: Peymann, Toralf; Knobler, Carolyn B.; Khan, Saeed I.; Hawthorne, M. Frederick Dodecamethyl-closo-dodecaborate(2-) Inorganic Chemistry 40(6) (2001) 1291-1294 Space group: P c 21 n Cell volume: 3337 Cell parameters: 9.715; 15.052; 22.819; 90; 90; 90;

COD ID: 4332956

Formula: - C15 H27 In N2 O S3 -
Comments: Briand, Glen G.; Cooper, Benjamin F. T.; MacDonald, David B. S.; Martin, Caleb D.; Schatte, Gabriele Preferred Bonding Motif for Indium Aminoethanethiolate Complexes: Structural Characterization of (Me2NCH2CH2S)2InX/SR (X = Cl, I; R = 4-MeC6H4, 4-MeOC6H4) Inorganic Chemistry 45(20) (2006) 8423-8429
Space group: P c 21 n
Cell volume: 1971.2
Cell parameters: 7.1598; 8.784; 31.3428; 90; 90; 90;

COD ID: 4336698

Formula: - C26 H22 O5 P Re -
Comments: Charalampos Triantis; Theodoros Tsotakos; Charalampos Tsoukalas; Marina Sagnou; Catherine Raptopoulou; Aris Terzis; Vassilis Psycharis; Maria Pelecanou; Ioannis Pirmettis; Minas Papadopoulos Synthesis and Characterization of fac-[M(CO)3(P)(OO)] and cis-trans-[M(CO)2(P)2(OO)] Complexes (M = Re,99mTc) with Acetylacetone and Curcumin as OO Donor Bidentate Ligands Inorganic Chemistry 52 (2013) 12995-13003
Space group: P c 21 n
Cell volume: 2371.81
Cell parameters: 8.8359; 14.7292; 18.2243; 90; 90; 90;

COD ID: 4339274
CIF file	Formula: - Lu12.713 Zn58.534 - Comments: Piao, Shuying; Lidin, Sven Occupation waves the way you have never seen them: the orthorhombic quasicrystal approximants RE(13)Zn(58+)(delta) (RE = Ho, Er, Tm, and Lu). Inorganic chemistry 46(16) (2007) 6452-6463 Space group: P c 21 n Cell volume: 4798.1 Cell parameters: 24.4282; 14.1116; 13.9187; 90; 90; 90;

COD ID: 4339276
CIF file	Formula: - Tm12.88 Zn58.64 - Comments: Piao, Shuying; Lidin, Sven Occupation waves the way you have never seen them: the orthorhombic quasicrystal approximants RE(13)Zn(58+)(delta) (RE = Ho, Er, Tm, and Lu). Inorganic chemistry 46(16) (2007) 6452-6463 Space group: P c 21 n Cell volume: 4843.6 Cell parameters: 24.5152; 14.165; 13.948; 90; 90; 90;

COD ID: 4339277
CIF file	Formula: - Er12.887 Zn58.817 - Comments: Piao, Shuying; Lidin, Sven Occupation waves the way you have never seen them: the orthorhombic quasicrystal approximants RE(13)Zn(58+)(delta) (RE = Ho, Er, Tm, and Lu). Inorganic chemistry 46(16) (2007) 6452-6463 Space group: P c 21 n Cell volume: 4941.4 Cell parameters: 24.6949; 14.2471; 14.0449; 90; 90; 90;

COD ID: 4339476

Formula: - C36 H60 Co3 Cr2 O42 -
Comments: Coronado, Eugenio; Galan-Mascarós, José R; Martí-Gastaldo, Carlos A "cation-less" oxalate-based ferromagnet formed by neutral bimetallic layers: {[Co(H2O)2]3[Cr(ox)3]2(18-crown-6)2}(infinity) (ox = oxalate dianion; 18-crown-6 = C12H24O6). Inorganic chemistry 46(20) (2007) 8108-8110
Space group: P c 21 n
Cell volume: 6008.3
Cell parameters: 14.395; 15.65; 26.67; 90; 90; 90;

COD ID: 4343572
CIF file	Formula: - Ni O4 P Rb - Comments: Henry, P.F.; Hughes, R.W.; Weller, M.T. Nikel phosphate based zeotype, Rb Ni P O4 Inorganic Chemistry 39 (2000) 5420-5421 Space group: P c 21 n Cell volume: 421.699 Cell parameters: 9.28673; 5.08216; 8.93493; 90; 90; 90;

COD ID: 4510683

Formula: - C6 H13 Cl N2 O4 -
Comments: Olejniczak, Anna; Anioła, Michalina; Szafrański, Marek; Budzianowski, Armand; Katrusiak, Andrzej New Polar Phases of 1,4-Diazabicyclo[2.2.2]octane Perchlorate, An NH+···N Hydrogen-Bonded Ferroelectric Crystal Growth & Design 13(7) (2013) 2872
Space group: P c 21 n
Cell volume: 898.73
Cell parameters: 8.6339; 9.7493; 10.677; 90; 90; 90;

COD ID: 4510684

Formula: - C6 H13 Cl N2 O4 -
Comments: Olejniczak, Anna; Anioła, Michalina; Szafrański, Marek; Budzianowski, Armand; Katrusiak, Andrzej New Polar Phases of 1,4-Diazabicyclo[2.2.2]octane Perchlorate, An NH+···N Hydrogen-Bonded Ferroelectric Crystal Growth & Design 13(7) (2013) 2872
Space group: P c 21 n
Cell volume: 898.97
Cell parameters: 8.6363; 9.7488; 10.6774; 90; 90; 90;

COD ID: 4510685

Formula: - C6 H13 Cl N2 O4 -
Comments: Olejniczak, Anna; Anioła, Michalina; Szafrański, Marek; Budzianowski, Armand; Katrusiak, Andrzej New Polar Phases of 1,4-Diazabicyclo[2.2.2]octane Perchlorate, An NH+···N Hydrogen-Bonded Ferroelectric Crystal Growth & Design 13(7) (2013) 2872
Space group: P c 21 n
Cell volume: 899.39
Cell parameters: 8.6391; 9.7496; 10.6781; 90; 90; 90;

COD ID: 4510686

Formula: - C6 H13 Cl N2 O4 -
Comments: Olejniczak, Anna; Anioła, Michalina; Szafrański, Marek; Budzianowski, Armand; Katrusiak, Andrzej New Polar Phases of 1,4-Diazabicyclo[2.2.2]octane Perchlorate, An NH+···N Hydrogen-Bonded Ferroelectric Crystal Growth & Design 13(7) (2013) 2872
Space group: P c 21 n
Cell volume: 902.46
Cell parameters: 8.6694; 9.7494; 10.6773; 90; 90; 90;

COD ID: 4510687

Formula: - C6 H13 Cl N2 O4 -
Comments: Olejniczak, Anna; Anioła, Michalina; Szafrański, Marek; Budzianowski, Armand; Katrusiak, Andrzej New Polar Phases of 1,4-Diazabicyclo[2.2.2]octane Perchlorate, An NH+···N Hydrogen-Bonded Ferroelectric Crystal Growth & Design 13(7) (2013) 2872
Space group: P c 21 n
Cell volume: 906.45
Cell parameters: 8.7025; 9.7517; 10.6812; 90; 90; 90;

COD ID: 4510688

Formula: - C6 H13 Cl N2 O4 -
Comments: Olejniczak, Anna; Anioła, Michalina; Szafrański, Marek; Budzianowski, Armand; Katrusiak, Andrzej New Polar Phases of 1,4-Diazabicyclo[2.2.2]octane Perchlorate, An NH+···N Hydrogen-Bonded Ferroelectric Crystal Growth & Design 13(7) (2013) 2872
Space group: P c 21 n
Cell volume: 910.81
Cell parameters: 8.7381; 9.7559; 10.6842; 90; 90; 90;

COD ID: 4510689

Formula: - C6 H13 Cl N2 O4 -
Comments: Olejniczak, Anna; Anioła, Michalina; Szafrański, Marek; Budzianowski, Armand; Katrusiak, Andrzej New Polar Phases of 1,4-Diazabicyclo[2.2.2]octane Perchlorate, An NH+···N Hydrogen-Bonded Ferroelectric Crystal Growth & Design 13(7) (2013) 2872
Space group: P c 21 n
Cell volume: 910.99
Cell parameters: 8.7429; 9.7551; 10.6814; 90; 90; 90;

COD ID: 4510690

Formula: - C6 H13 Cl N2 O4 -
Comments: Olejniczak, Anna; Anioła, Michalina; Szafrański, Marek; Budzianowski, Armand; Katrusiak, Andrzej New Polar Phases of 1,4-Diazabicyclo[2.2.2]octane Perchlorate, An NH+···N Hydrogen-Bonded Ferroelectric Crystal Growth & Design 13(7) (2013) 2872
Space group: P c 21 n
Cell volume: 911.45
Cell parameters: 8.7476; 9.7566; 10.67932; 90; 90; 90;

COD ID: 4510691

Formula: - C6 H13 Cl N2 O4 -
Comments: Olejniczak, Anna; Anioła, Michalina; Szafrański, Marek; Budzianowski, Armand; Katrusiak, Andrzej New Polar Phases of 1,4-Diazabicyclo[2.2.2]octane Perchlorate, An NH+···N Hydrogen-Bonded Ferroelectric Crystal Growth & Design 13(7) (2013) 2872
Space group: P c 21 n
Cell volume: 911.57
Cell parameters: 8.7516; 9.75; 10.6831; 90; 90; 90;

COD ID: 4510692

Formula: - C6 H13 Cl N2 O4 -
Comments: Olejniczak, Anna; Anioła, Michalina; Szafrański, Marek; Budzianowski, Armand; Katrusiak, Andrzej New Polar Phases of 1,4-Diazabicyclo[2.2.2]octane Perchlorate, An NH+···N Hydrogen-Bonded Ferroelectric Crystal Growth & Design 13(7) (2013) 2872
Space group: P c 21 n
Cell volume: 912.56
Cell parameters: 8.7564; 9.7605; 10.6773; 90; 90; 90;

COD ID: 4510693

Formula: - C6 H13 Cl N2 O4 -
Comments: Olejniczak, Anna; Anioła, Michalina; Szafrański, Marek; Budzianowski, Armand; Katrusiak, Andrzej New Polar Phases of 1,4-Diazabicyclo[2.2.2]octane Perchlorate, An NH+···N Hydrogen-Bonded Ferroelectric Crystal Growth & Design 13(7) (2013) 2872
Space group: P c 21 n
Cell volume: 912.92
Cell parameters: 8.761; 9.7586; 10.678; 90; 90; 90;

COD ID: 4510694

Formula: - C6 H13 Cl N2 O4 -
Comments: Olejniczak, Anna; Anioła, Michalina; Szafrański, Marek; Budzianowski, Armand; Katrusiak, Andrzej New Polar Phases of 1,4-Diazabicyclo[2.2.2]octane Perchlorate, An NH+···N Hydrogen-Bonded Ferroelectric Crystal Growth & Design 13(7) (2013) 2872
Space group: P c 21 n
Cell volume: 913.16
Cell parameters: 8.766; 9.758; 10.6754; 90; 90; 90;

COD ID: 4510695

Formula: - C6 H13 Cl N2 O4 -
Comments: Olejniczak, Anna; Anioła, Michalina; Szafrański, Marek; Budzianowski, Armand; Katrusiak, Andrzej New Polar Phases of 1,4-Diazabicyclo[2.2.2]octane Perchlorate, An NH+···N Hydrogen-Bonded Ferroelectric Crystal Growth & Design 13(7) (2013) 2872
Space group: P c 21 n
Cell volume: 913.55
Cell parameters: 8.7689; 9.7602; 10.674; 90; 90; 90;

COD ID: 4510696

Formula: - C6 H13 Cl N2 O4 -
Comments: Olejniczak, Anna; Anioła, Michalina; Szafrański, Marek; Budzianowski, Armand; Katrusiak, Andrzej New Polar Phases of 1,4-Diazabicyclo[2.2.2]octane Perchlorate, An NH+···N Hydrogen-Bonded Ferroelectric Crystal Growth & Design 13(7) (2013) 2872
Space group: P c 21 n
Cell volume: 925.86
Cell parameters: 8.8777; 9.7614; 10.684; 90; 90; 90;

COD ID: 4510706
CIF file	Formula: - C6 H13 Cl N2 O4 - Comments: Olejniczak, Anna; Anioła, Michalina; Szafrański, Marek; Budzianowski, Armand; Katrusiak, Andrzej New Polar Phases of 1,4-Diazabicyclo[2.2.2]octane Perchlorate, An NH+···N Hydrogen-Bonded Ferroelectric Crystal Growth & Design 13(7) (2013) 2872 Space group: P c 21 n Cell volume: 853 Cell parameters: 8.496; 9.4293; 10.6475; 90; 90; 90;

COD ID: 4514237

Formula: - C28 H29 Cl Fe P S -
Comments: Song, Heng; Ye, Ke; Geng, Peiyu; Han, Xiao; Liao, Rongzhen; Tung, Chen-Ho; Wang, Wenguang Activation of Epoxides by a Cooperative Iron‒Thiolate Catalyst: Intermediacy of Ferrous Alkoxides in Catalytic Hydroboration ACS Catalysis 7(11) (2017) 7709
Space group: P c 21 n
Cell volume: 2420.3
Cell parameters: 10.13; 14.433; 16.554; 90; 90; 90;

COD ID: 4514238

Formula: - C29 H29 Fe O P S -
Comments: Song, Heng; Ye, Ke; Geng, Peiyu; Han, Xiao; Liao, Rongzhen; Tung, Chen-Ho; Wang, Wenguang Activation of Epoxides by a Cooperative Iron‒Thiolate Catalyst: Intermediacy of Ferrous Alkoxides in Catalytic Hydroboration ACS Catalysis 7(11) (2017) 7709
Space group: P c 21 n
Cell volume: 2451.2
Cell parameters: 10.1455; 14.4475; 16.7227; 90; 90; 90;

COD ID: 4517535

Formula: - C16 H6 F2 N4 O -
Comments: Kvashnin, Yuriy A.; Verbitskiy, Egor V.; Eltsov, Oleg S.; Slepukhin, Pavel A.; Tameev, Alexey R.; Nekrasova, Natalia V.; Rusinov, Gennady L.; Nunzi, Jean-Michel; Chupakhin, Oleg N.; Charushin, Valery N. Dibenzo[f,h]furazano[3,4-b]quinoxalines: Synthesis by Intramolecular Cyclization through Direct Transition Metal-Free C‒H Functionalization and Electrochemical, Photophysical, and Charge Mobility Characterization ACS Omega (2020)
Space group: P c 21 n
Cell volume: 1234.2
Cell parameters: 4.495; 13.8963; 19.758; 90; 90; 90;

COD ID: 7005667

Formula: - C13 H13 Br Cl N3 O6 -
Comments: Bernhardt, Paul V.; Chin, Piao; Sharpe, Philip C.; Richardson, Des R. Hydrazone chelators for the treatment of iron overload disorders: iron coordination chemistry and biological activity. Dalton transactions (Cambridge, England : 2003) (issue 30) (2007) 3232-3244
Space group: P c 21 n
Cell volume: 1643.2
Cell parameters: 10.434; 10.72; 14.691; 90; 90; 90;

COD ID: 7013193

Formula: - C14 H17 Fe N12 -
Comments: Mukherjee, Jhumpa; Balamurugan, V.; Gupta, Rajeev; Mukherjee, Rabindranath Synthesis and properties of FeIII and CoIII complexes: structures of [(L2)Fe(N3)3], [(L2)2Fe2(�-O)(�-O2CMe)2][ClO4]2�2H2O and [(L2)2Co2(�-OH)2(�-O2CMe)][ClO4]3�MeCN [L2 = methyl[2-(2-pyridyl)ethyl](2-pyridylmethyl)amine]Electronic supplementary information (ESI) available: Fig. S1?S3 discussed in the text. See http://www.rsc.org/suppdata/dt/b3/b305470e/ Dalton Transactions (issue 19) (2003) 3686
Space group: P c 21 n
Cell volume: 1835.8
Cell parameters: 8.526; 14.119; 15.25; 90; 90; 90;

COD ID: 7016918

Formula: - C27 H18 N3 O4 Re -
Comments: Griffiths, D. Vaughan; Cheong, Yuen-Ki; Duncanson, Philip; Motevalli, Majid Studies of the reactions of tripodal pyridine-containing ligands with Re(CO)(5)Br leading to rheniumtricarbonyl complexes with potential biomedical applications. Dalton transactions (Cambridge, England : 2003) 40(39) (2011) 10215-10228
Space group: P c 21 n
Cell volume: 2291.76
Cell parameters: 11.0493; 12.7288; 16.2947; 90; 90; 90;

COD ID: 7018668

Formula: - C33 H33 Cl2 O2 P Ru -
Comments: Kabro, Anzhelika; Ghattas, Ghazi; Roisnel, Thierry; Fischmeister, Cédric; Bruneau, Christian New ruthenium metathesis catalysts with chelating indenylidene ligands: synthesis, characterization and reactivity. Dalton transactions (Cambridge, England : 2003) 41(13) (2012) 3695-3700
Space group: P c 21 n
Cell volume: 2969.89
Cell parameters: 9.388; 13.0791; 24.1874; 90; 90; 90;

COD ID: 7025395

Formula: - C27 H33 N6 O14 Tb -
Comments: Mooibroek, Tiddo Jonathan; Gamez, Patrick; Pevec, Andrej; Kasunic, Marta; Kozlevcar, Bojan; Fu, Wen-Tian; Reedijk, Jan Efficient, stable, tunable, and easy to synthesize, handle and recycle luminescent materials: [H2NMe2]3[Ln(III)(2,6-dipicolinolate)3] (Ln = Eu, Tb, or its solid solutions). Dalton transactions (Cambridge, England : 2003) 39(28) (2010) 6483-6487
Space group: P c 21 n
Cell volume: 3411.43
Cell parameters: 10.6792; 17.0739; 18.7096; 90; 90; 90;

COD ID: 7026585
CIF file	Formula: - C24 H46 Li N3 O - Comments: Cousins, David M.; Davidson, Matthew G.; García-Vivó, Daniel; Mahon, Mary F. Structural diversity in polyamine Lewis base stabilised lithium aryloxides. Dalton transactions (Cambridge, England : 2003) 39(35) (2010) 8203-8209 Space group: P c 21 n Cell volume: 5100.67 Cell parameters: 8.908; 15.605; 36.693; 90; 90; 90;

COD ID: 7027417
CIF file	Formula: - C12 H26 Cl Na O11 - Comments: Steed, Jonathan W.; Junk, Peter C. Stabilisation of sodium complexes of 18-crown-6 by intramolecular hydrogen bonding † Journal of the Chemical Society, Dalton Transactions (issue 13) (1999) 2141 Space group: P c 21 n Cell volume: 1877.38 Cell parameters: 9.1846; 13.9712; 14.6305; 90; 90; 90;

COD ID: 7033799
CIF file	Formula: - C22 H60 Ag2 N2 Si8 - Comments: Sgro, Michael J.; Piers, Warren E.; Romero, Patricio E. Synthesis, structural characterization and thermal properties of copper and silver silyl complexes. Dalton transactions (Cambridge, England : 2003) 44(8) (2015) 3817-3828 Space group: P c 21 n Cell volume: 4030.2 Cell parameters: 13.123; 13.736; 22.358; 90; 90; 90;

COD ID: 7053667

Formula: - C44 H45 Cu2 N10 O14.5 -
Comments: Déniz, Mariadel; Pasán, Jorge; Fabelo, Oscar; Cañadillas-Delgado, Laura; Lloret, Francesc; Julve, Miguel; Ruiz-Pérez, Catalina Metal-organic coordination frameworks based on mixed methylmalonate and 4,4′-bipiridine ligands: synthesis, crystal structure and magnetic properties New Journal of Chemistry 34(11) (2010) 2515
Space group: P c 21 n
Cell volume: 4652.1
Cell parameters: 15.814; 15.9037; 18.4974; 90; 90; 90;

COD ID: 7112388

Formula: - C22 H31 Al N2 -
Comments: Abdalla, Joseph A. B.; Riddlestone, Ian M.; Tirfoin, Remi; Phillips, Nicholas; Bates, Joshua I.; Aldridge, Simon Al-H σ-bond coordination: expanded ring carbene adducts of AlH3 as neutral bi- and tri-functional donor ligands. Chemical communications (Cambridge, England) 49(49) (2013) 5547-5549
Space group: P c 21 n
Cell volume: 2074.1
Cell parameters: 8.1095; 15.6301; 16.3634; 90; 90; 90;

COD ID: 7117432
CIF file	Formula: - Cu O4 P Rb - Comments: Henry, P.F.; Hughes, R.W.; Weller, M.T.; Ward, S.C. Rb Cu P O4 - a maximum copper tetrahedral framework adopting the zeotype ABW structure Chemical Communications 2000 (2000) 1959-1960 Space group: P c 21 n Cell volume: 406.733 Cell parameters: 8.5261; 5.3562; 8.9064; 90; 90; 90;

COD ID: 7152392

Formula: - C9 H7 I2 N3 O -
Comments: Chevallier, Floris; Blin, Thomas; Nagaradja, Elisabeth; Lassagne, Frédéric; Roisnel, Thierry; Halauko, Yury S.; Matulis, Vadim E.; Ivashkevich, Oleg A.; Mongin, Florence Deproto-metallation and computed CH acidity of 2-aryl-1,2,3-triazoles. Organic & biomolecular chemistry 10(25) (2012) 4878-4885
Space group: P c 21 n
Cell volume: 1155.91
Cell parameters: 4.1304; 12.9948; 21.5358; 90; 90; 90;

COD ID: 7152394

Formula: - C8 H6 I N3 -
Comments: Chevallier, Floris; Blin, Thomas; Nagaradja, Elisabeth; Lassagne, Frédéric; Roisnel, Thierry; Halauko, Yury S.; Matulis, Vadim E.; Ivashkevich, Oleg A.; Mongin, Florence Deproto-metallation and computed CH acidity of 2-aryl-1,2,3-triazoles. Organic & biomolecular chemistry 10(25) (2012) 4878-4885
Space group: P c 21 n
Cell volume: 879.97
Cell parameters: 4.3176; 13.3505; 15.2661; 90; 90; 90;

COD ID: 7152395

Formula: - C8 H5 Cl I N3 -
Comments: Chevallier, Floris; Blin, Thomas; Nagaradja, Elisabeth; Lassagne, Frédéric; Roisnel, Thierry; Halauko, Yury S.; Matulis, Vadim E.; Ivashkevich, Oleg A.; Mongin, Florence Deproto-metallation and computed CH acidity of 2-aryl-1,2,3-triazoles. Organic & biomolecular chemistry 10(25) (2012) 4878-4885
Space group: P c 21 n
Cell volume: 957.1
Cell parameters: 4.2056; 13.2551; 17.169; 90; 90; 90;

COD ID: 7218542

Formula: - C40 H66 Cl N26 Nd O29 -
Comments: Zhou, Jia-Jia; Yu, Xin; Zhao, Ying-Chun; Xiao, Xin; Zhang, Yun-Qian; Xue, Sai-Feng; Tao, Zhu; Liu, Jing-Xin; Zhu, Qian-Jiang Coordination of Ln3+in ortho-tetramethyl-substituted cucurbituril supramolecular assemblies formed in the presence of cadmium nitrate: potential applications for isolation of heavier lanthanides CrystEngComm 16(46) (2014) 10674
Space group: P c 21 n
Cell volume: 5996
Cell parameters: 14.639; 17.452; 23.468; 90; 90; 90;

COD ID: 7218543

Formula: - C40 H66 Cl N26 O29 Sm -
Comments: Zhou, Jia-Jia; Yu, Xin; Zhao, Ying-Chun; Xiao, Xin; Zhang, Yun-Qian; Xue, Sai-Feng; Tao, Zhu; Liu, Jing-Xin; Zhu, Qian-Jiang Coordination of Ln3+in ortho-tetramethyl-substituted cucurbituril supramolecular assemblies formed in the presence of cadmium nitrate: potential applications for isolation of heavier lanthanides CrystEngComm 16(46) (2014) 10674
Space group: P c 21 n
Cell volume: 5956.1
Cell parameters: 14.6418; 17.407; 23.369; 90; 90; 90;

COD ID: 7218544

Formula: - C40 H66 Cl Eu N26 O29 -
Comments: Zhou, Jia-Jia; Yu, Xin; Zhao, Ying-Chun; Xiao, Xin; Zhang, Yun-Qian; Xue, Sai-Feng; Tao, Zhu; Liu, Jing-Xin; Zhu, Qian-Jiang Coordination of Ln3+in ortho-tetramethyl-substituted cucurbituril supramolecular assemblies formed in the presence of cadmium nitrate: potential applications for isolation of heavier lanthanides CrystEngComm 16(46) (2014) 10674
Space group: P c 21 n
Cell volume: 5954
Cell parameters: 14.641; 17.416; 23.351; 90; 90; 90;

COD ID: 7226797
CIF file	Formula: - C28 H27 N3 - Comments: Girgis, AS; Ismail, Nasser Saad; George, Riham F.; Serya, Rabah; Baselious, Fady N.; El-Manawaty, May; Shalaby, ElSayed M. Rational design, synthesis and 2D-QSAR studies of antiproliferative tropane-based compounds RSC Adv. (2016) Space group: P c 21 n Cell volume: 2245.03 Cell parameters: 6.0216; 18.9648; 19.659; 90; 90; 90;

COD ID: 7233132

Formula: - C27 H26 Gd N6 O14 -
Comments: Huabin Zhang; Xiaochen Shan; Liujiang Zhou; Ping Lin; Renfu Li; En Ma; Xiangguang Guo; Shaowu Du Full-colour fluorescent materials based on mixed-lanthanide(III) metal-organic complexes with high-efficiency white light emission Journal of Materials Chemistry C 1 (2013) 888-891
Space group: P c 21 n
Cell volume: 3384.6
Cell parameters: 10.701; 16.98; 18.627; 90; 90; 90;

COD ID: 7238474
CIF file	Formula: - C23 H24 Cl N O2 Ru - Comments: Godó, Attila J.; Bényei, Attila Cs.; Duff, Brian; Egan, Denise A.; Buglyó, Péter Synthesis and X-ray diffraction structures of novel half-sandwich Os(ii)-and Ru(ii)-hydroxamate complexes RSC Adv. 2(4) (2012) 1486 Space group: P c 21 n Cell volume: 2160 Cell parameters: 9.902; 10.38; 21.015; 90; 90; 90;

COD ID: 9010466