Crystallography Open Database

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2009541 CIF
Paper
C10 H5 O9 Os3 PP c a b17.108; 14.229; 14.485
90; 90; 90
3526Blake, A.J.; Ebsworth, E.A.V.; McIntosh, A.P.; Schröder, M.
A series of osmium carbonyl complexes with related terminal, bridging and capping phosphorus ligands
Acta Crystallographica Section C, 1994, 50, 371-375
2009583 CIF
Paper
C11 H29 Cl2 Cu N5 O8P c a b14.599; 14.919; 18.756
90; 90; 90
4085.1Tahirov, T.H.; Lu, T.-H.; Liu, Y.-L.; Chung, C.-S.
[(2<i>RS</i>,5<i>SR</i>,8<i>SR</i>,12<i>SR</i>,15<i>SR</i>)-2,5,8,12,15-Pentaazahexadecane-κ^5^<i>N</i>^2,5,8,12,15^]copper(II) diperchlorate
Acta Crystallographica Section C, 1994, 50, 514-516
2009640 CIF
Paper
C5 H7 N3 O2P c a b7.724; 10.513; 16.034
90; 90; 90
1302Olszak, Tomasz A.; Peeters, O.M.; Blaton, N.M.; De Ranter, C.J.
2,5-Dimethyl-4-nitroimidazole
Acta Crystallographica Section C, 1994, 50, 558-559
2009699 CIF
Paper
C10 H11 N O3P c a b15.93; 10.86; 11.135
90; 90; 90
1926.4Feeder, N.; Jones, W.
3-(Benzoylamino)propanoic acid and 6-[(4-nitrobenzoyl)amino]hexanoic acid
Acta Crystallographica Section C, 1994, 50, 813-816
2009702 CIF
Paper
C12 H15 N O3P c a b24.22; 9.675; 10.094
90; 90; 90
2365Feeder, N.; Jones, W.
6-Oxo-6-(phenylamino)hexanoic acid [two polymorphic forms, (I) and (II)] and 4-oxo-4-(<i>N</i>-methylphenylamino)butanoic acid (III)
Acta Crystallographica Section C, 1994, 50, 816-820
2009874 CIF
Paper
C12 H36 Br6 P4 Rh2P c a b10.971; 15.562; 16.459
90; 90; 90
2810.1Boyd, S.E.; Field, L.D.; Hambley, T.W.
Di-μ-bromo-tetrabromotetrakis(trimethylphosphine)dirhodium(III)
Acta Crystallographica Section C, 1994, 50, 1019-1020
2010097 CIF
Paper
C H7 Al3 N O13 P3P c a b10.281; 13.844; 17.064
90; 90; 90
2428.7Chippindale, A.M.; Powell, A.V.; Jones, R.H.; Thomas, J.M.; Cheetham, A.K.; Huo, Q.; Xu, R.
A three-dimensional framework aluminophosphate (CH~3~NH~3~)^+^[Al~3~P~3~O~13~H]^{-^}
Acta Crystallographica Section C, 1994, 50, 1537-1540
2013713 CIF
HKL
Paper
C11 H27 Cl5 Co N5 ZnP c a b11.619; 14.109; 23.517
90; 90; 90
3855.2Bernhardt, Paul V.; Macpherson, Brendan P.
Geometric isomers of chloro(6-methyl-1,4,8,11-tetraazacyclotetradecane-6-amine)cobalt(III) tetrachlorozincate(II)
Acta Crystallographica Section C, 2003, 59, m467-m470
2019273 CIF
Paper
Cl2 H16 Mg O8P c a b11.9153; 6.7482; 13.6052
90; 90; 90
1093.95Hennings, Erik; Schmidt, Horst; Voigt, Wolfgang
Crystal structures of hydrates of simple inorganic salts. I. Water-rich magnesium halide hydrates MgCl~2~·8H~2~O, MgCl~2~·12H~2~O, MgBr~2~·6H~2~O, MgBr~2~·9H~2~O, MgI~2~·8H~2~O and MgI~2~·9H~2~O
Acta Crystallographica Section C, 2013, 69, 1292-1300
2020128 CIF
HKL
C12 H20 Cl N OP c a b9.6852; 10.7589; 23.7261
90; 90; 90
2472.31Stepanovs, Dmitrijs; Posevins, Daniels; Turks, Maris
Crystal structures of two (±)-exo-N-isobornylacetamides
Acta Crystallographica Section E Crystallographic Communications, 2015, 71, 1117
2021442 CIF
HKL
Paper
C10 H12 Cd Cl2 N6 O5P c a b7.2637; 17.7011; 24.3144
90; 90; 90
3126.24Bouchene, Rafika; Bouacida, Sofiane
Syntheses, supramolecular networks and Hirshfeld surface and thermal analyses of two new cadmium chloride coordination polymers with an <i>N</i>,<i>O</i>-chelating ligand
Acta Crystallographica Section C, 2019, 75
2100977 CIF
Paper
C5 H7 N3 O6 SP c a b29.617; 13.185; 9.013
90; 90; 90
3519.6Pecaut, J.; Le Fur, Y.; Masse, R.
Crystal engineering and structural investigations of the 2-amino-5-nitropyridinium salts C~5~H~6~N~3~O~2~^+^.HSO~4~^{-^} and C~5~H~6~N~3~O~2~^+^.H~2~AsO~4~^{-^}
Acta Crystallographica Section B, 1993, 49, 535-541
2200252 CIF
HKL
Paper
C15 H21 O6 VP c a b15.4466; 16.6228; 13.5016
90; 90; 90
3466.7Filgueiras, Carlos A. L.; Horn Jr, Adolfo; Howie, R. Alan; Skakle, Janet M. S.; Wardell, James L.
α-Form of tris(2,4-pentanedionato-<i>O</i>,<i>O</i>')vanadium(III), re-refinement against new intensity data
Acta Crystallographica Section E, 2001, 57, m157-m158
2203823 CIF
HKL
Paper
C10 H8 N2 O2P c a b7.494; 13.915; 18.377
90; 90; 90
1916.3Ustabaş, Reşat; Çoruh, Ufuk; Sancak, Kemal; Er, Mustafa; Ünver, Yasemin; Yavuz, Metin
2-[2-(Cyanomethoxy)phenoxy]acetonitrile
Acta Crystallographica Section E, 2004, 60, o968-o970
2205038 CIF
HKL
Paper
C24 H20 N2 O4P c a b10.8731; 18.7861; 20.5836
90; 90; 90
4204.5Yıldırım, İsmail; Özdemir, Namık; Akçamur, Yunus; Dinçer, Muharrem; Andaç, Ömer
4-Benzoyl-1,5-diphenyl-1<i>H</i>-pyrazole-3-carboxylic acid methanol solvate
Acta Crystallographica Section E, 2005, 61, o256-o258
2206212 CIF
HKL
Paper
C20 H16 N2 O2P c a b7.4651; 13.0034; 15.9759
90; 90; 90
1550.8Zhu, Hong-Jun; Wang, Dan-Dan; Song, Guang-Liang; Wang, Jin-Tang; Wang, Ke-Le
2,5-Dibenzoyl-1,4-phenylenediamine
Acta Crystallographica Section E, 2005, 61, o2209-o2210
2207747 CIF
HKL
Paper
C22 H18 O2 SP c a b7.508; 16.493; 27.952
90; 90; 90
3461K. Palani; P. Amaladass; A. K. Mohanakrishnan; M. N. Ponnuswamy
1,3-Bis(4-methoxyphenyl)-2-benzothiophene
Acta Crystallographica Section E, 2006, 62, o49-o51
2209068 CIF
HKL
Paper
C21 H16 Cl N3P c a b8.0836; 27.952; 30.483
90; 90; 90
6887.7Seferoğlu, Zeynel; Hökelek, Tuncer; Şahin, Ertan; Ertan, Nermin
3-(4-Chlorophenyldiazenyl)-1-methyl-2-phenyl-1<i>H</i>-indole
Acta Crystallographica Section E, 2006, 62, o2108-o2110
2211383 CIF
HKL
Paper
C12 H10 Cd N2 O8P c a b8.665; 17.392; 18.812
90; 90; 90
2835Knight, James; Amoroso, Angelo; Edwards, Peter; Ooi, Li-Ling
<i>catena</i>-Poly[[[diaquacadmium(II)]-μ-2,2'-bipyridine-6,6'-dicarboxylato] dihydrate]
Acta Crystallographica Section E, 2006, 62, m3306-m3308
2214292 CIF
HKL
Paper
C28 H34 N6 O6 ZnP c a b15.3277; 16.3989; 24.8735
90; 90; 90
6252.1Min Zhang; Hui-Li Weng; Bo Hu; Xing-Man Xu
{[<i>N</i>,<i>N</i>'-Bis(4-methoxybenzyl)ethane-1,2-diyldiimino]diacetato-κ^4^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>'}bis(1<i>H</i>-imidazole-κ<i>N</i>^3^)zinc(II)
Acta Crystallographica Section E, 2007, 63, m1797-m1797
2214523 CIF
HKL
Paper
C28 H38 Cd N6 O8P c a b15.7646; 16.3172; 24.7351
90; 90; 90
6362.7Min Zhang; She-Min Lan; Hui-Li Weng; Xing-Man Xu
{[<i>N</i>,<i>N</i>'-Bis(4-methoxybenzyl)ethane-1,2-diyldiimino]diacetato}bis(1<i>H</i>-imidazole-κ<i>N</i>^3^)cadmium(II) dihydrate
Acta Crystallographica Section E, 2007, 63, m2045-m2045
2217089 CIF
HKL
Paper
Fe Na O6 Te2P c a b7.853; 10.448; 13.438
90; 90; 90
1102.6Weil, Matthias; Stöger, Berthold
NaFe(TeO~3~)~2~
Acta Crystallographica Section E, 2008, 64, i3-i3
2232694 CIF
HKL
Paper
C15 H18 Cl Cu N3 O7P c a b8.809; 19.9017; 20.9053
90; 90; 90
3664.99Ourari, Ali; Derafa, Wassila; Bouacida, Sofiane; Aggoun, Djouhra
<i>catena</i>-Poly[[[(pyridine-κ<i>N</i>)copper(II)]-μ-3-{1-[(2-aminoethyl)imino]ethyl}-6-methyl-2-oxo-2<i>H</i>-pyran-4-olato-κ^4^<i>N</i>,<i>N</i>,<i>O</i>^4^:<i>O</i>^2^] perchlorate]
Acta Crystallographica Section E, 2011, 67, m1720-m1721
2234910 CIF
HKL
Paper
C48 H48 Co N3 O6P c a b15.9798; 19.2968; 27.4387
90; 90; 90
8461Ourari, Ali; Ouennoughi, Yasmina; Bouacida, Sofiane
Tris(2-{[2-(4-methoxyphenyl)ethyl]iminomethyl}phenolato-κ^2^<i>N</i>,<i>O</i>^1^)cobalt(III)
Acta Crystallographica Section E, 2012, 68, m803-m804
2237060 CIF
HKL
Paper
C6 H14 N2 O2 S2 Sn2P c a b8.344; 12.5214; 13.3871
90; 90; 90
1398.66Sow, Yaya; Diop, Libasse; Molloy, Kieran C.; Kociok-Köhn, Gabriele
Di-μ-hydroxido-bis[dimethyl(thiocyanato-κ<i>N</i>)tin(IV)]
Acta Crystallographica Section E, 2012, 68, m1436
2240120 CIF
HKL
Paper
C14 H10 Cl N O2P c a b6.0014; 13.9015; 28.867
90; 90; 90
2408.3García-Merinos, J. Pablo; López, Yliana; González-Campos, J. Betzabe; Aviña-Verduzco, Judit A.; Río, Rosa E. del; Santillan, Rosa
Crystal structure of <i>N</i>-[(<i>E</i>)-(1,3-benzodioxol-5-yl)methylidene]-4-chloroaniline
Acta Crystallographica Section E, 2014, 70, o1195-o1196
2242357 CIF
HKL
Paper
C15 H18 Ce F9 O9P c a b11.6347; 16.5121; 24.5577
90; 90; 90
4717.9Koizumi, Atsuya; Hasegawa, Takuya; Itadani, Atsushi; Toda, Kenji; Zhu, Taoyun; Sato, Mineo
Structure of triaquatris(1,1,1-trifluoro-4-oxopentan-2-olato)cerium(III) as a possible fluorescent compound
Acta Crystallographica Section E, 2018, 74, 229-232
2310460 CIFC2 N2P c a b6.31; 7.08; 6.19
90; 90; 90
276.537Parkes, A.S.; Hughes, R.E.
The crystal structure of cyanogen
Acta Crystallographica (1,1948-23,1967), 1963, 16, 734-736
2310700 CIFH3 Na O2P c a b6.21; 11.72; 6.05
90; 90; 90
440.326Wunderlich, J.A.
Structures cristallines des hydrates de la soude. III. La structure cristalline de Na O H H2 O
Acta Crystallographica (1,1948-23,1967), 1957, 10, 462-463
2311677 CIF
Paper
C11 H13 Cl N2 O2P c a b5.183; 16.808; 27.247
90; 90; 90
2373.6Carletta, Andrea; Tilborg, Anaëlle; Moineaux, Laurence; de Ruyck, Jérôme; Basile, Livia; Salerno, Loredana; Romeo, Giuseppe; Wouters, Johan; Guccione, Salvatore
How does binding of imidazole-based inhibitors to heme oxygenase-1 influence their conformation? Insights combining crystal structures and molecular modelling.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2015, 71, 447-454
4001538 CIFCs2 Ga6 H2 O26 P6P c a b10.1662; 13.9762; 16.931
90; 90; 90
2405.6Lesage, J.; Guesdon, A.; Hervieu, M.; Raveau, B.
Unusual Mobility of Cesium via a Reversible Topotactic Dehydration Reaction in a New Hydroxygallophosphate with an Intersecting Tunnel Structure
Chemistry of Materials, 2006, 18, 2895
4003141 CIFC4 N O11 P2 S SmP c a b12.87191; 28.0795; 7.06792
90; 90; 90
2554.61Bazaga-García, Montse; Salcedo, Inés R.; Colodrero, Rosario M. P.; Xanthopoulos, Konstantinos; Villemin, Didier; Stock, Norbert; López-González, Mar; del Río, Carmen; Losilla, Enrique R.; Cabeza, Aurelio; Demadis, Konstantinos D.; Olivera-Pastor, Pascual
Layered Lanthanide Sulfophosphonates and Their Proton Conduction Properties in Membrane Electrode Assemblies
Chemistry of Materials, 2019
4003142 CIFC4 N Nd O11 P2 SP c a b12.93108; 27.9525; 7.11941
90; 90; 90
2573.35Bazaga-García, Montse; Salcedo, Inés R.; Colodrero, Rosario M. P.; Xanthopoulos, Konstantinos; Villemin, Didier; Stock, Norbert; López-González, Mar; del Río, Carmen; Losilla, Enrique R.; Cabeza, Aurelio; Demadis, Konstantinos D.; Olivera-Pastor, Pascual
Layered Lanthanide Sulfophosphonates and Their Proton Conduction Properties in Membrane Electrode Assemblies
Chemistry of Materials, 2019
4003143 CIFC4 Eu N O11 P2 SP c a b12.8176; 27.9047; 7.05997
90; 90; 90
2525.1Bazaga-García, Montse; Salcedo, Inés R.; Colodrero, Rosario M. P.; Xanthopoulos, Konstantinos; Villemin, Didier; Stock, Norbert; López-González, Mar; del Río, Carmen; Losilla, Enrique R.; Cabeza, Aurelio; Demadis, Konstantinos D.; Olivera-Pastor, Pascual
Layered Lanthanide Sulfophosphonates and Their Proton Conduction Properties in Membrane Electrode Assemblies
Chemistry of Materials, 2019
4003144 CIFC4 N O11 P2 Pr SP c a b12.98444; 27.9499; 7.15462
90; 90; 90
2596.51Bazaga-García, Montse; Salcedo, Inés R.; Colodrero, Rosario M. P.; Xanthopoulos, Konstantinos; Villemin, Didier; Stock, Norbert; López-González, Mar; del Río, Carmen; Losilla, Enrique R.; Cabeza, Aurelio; Demadis, Konstantinos D.; Olivera-Pastor, Pascual
Layered Lanthanide Sulfophosphonates and Their Proton Conduction Properties in Membrane Electrode Assemblies
Chemistry of Materials, 2019
4003145 CIFC4 N O11 P2 S TbP c a b12.7521; 27.9893; 7.01895
90; 90; 90
2505.2Bazaga-García, Montse; Salcedo, Inés R.; Colodrero, Rosario M. P.; Xanthopoulos, Konstantinos; Villemin, Didier; Stock, Norbert; López-González, Mar; del Río, Carmen; Losilla, Enrique R.; Cabeza, Aurelio; Demadis, Konstantinos D.; Olivera-Pastor, Pascual
Layered Lanthanide Sulfophosphonates and Their Proton Conduction Properties in Membrane Electrode Assemblies
Chemistry of Materials, 2019
4003146 CIFC4 Gd N O11 P2 SP c a b12.78286; 27.9621; 7.04068
90; 90; 90
2516.59Bazaga-García, Montse; Salcedo, Inés R.; Colodrero, Rosario M. P.; Xanthopoulos, Konstantinos; Villemin, Didier; Stock, Norbert; López-González, Mar; del Río, Carmen; Losilla, Enrique R.; Cabeza, Aurelio; Demadis, Konstantinos D.; Olivera-Pastor, Pascual
Layered Lanthanide Sulfophosphonates and Their Proton Conduction Properties in Membrane Electrode Assemblies
Chemistry of Materials, 2019
4020890 CIFC31 H42 Cl2 N3 O7 PP c a b15.1196; 17.9591; 25.632
90; 90; 90
6959.9N. Satish Kumar; K. Praveen Kumar; K. V. P. Pavan Kumar; Praveen Kommana; Jagadese J. Vittal; K. C. Kumara Swamy
Diverse Modes of Reactivity of Dialkyl Azodicarboxylates with P(III) Compounds: Synthesis, Structure, and Reactivity of Products Other than the Morrison-Brunn-Huisgen Intermediate in a Mitsunobu-Type Reaction
Journal of Organic Chemistry, 2004, 69, 1880-1889
4021044 CIFC10 H16 O5P c a b10.9443; 12.8927; 31.0269
90; 90; 90
4377.9David 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, 2004, 69, 8796-8803
4021627 CIFC16 H12 I2P c a b7.6944; 15.719; 25.11
90; 90; 90
3037.2Zhenfeng Xi; Zhiyi Song; Guangzhen Liu; Xiaozhong Liu; Tamotsu Takahashi
Preparation of Partially Substituted 1-Halo- and 1,4-Dihalo-1,3-dienes via Reagent-Controlled Desilylation of Halogenated 1,3-Dienes
Journal of Organic Chemistry, 2006, 71, 3154-3158
4022115 CIFC16 H12 O2P c a b8.4723; 16.42; 17.215
90; 90; 90
2394.8Manab Chakravarty; K. C. Kumara Swamy
Palladium-Catalyzed Coupling of Allenylphosphonates, Phenylallenes, and Allenyl Esters: Remarkable Salt Effect and Routes to Novel Benzofurans and Isocoumarins
Journal of Organic Chemistry, 2006, 71, 9128-9138
4022133 CIFC20 H38 N2 O4P c a b10.1031; 11.3618; 40.919
90; 90; 90
4697.1Albrecht Berkessel; Katrin Roland; Michael Schröder; Jörg M. Neudörfl; Johann Lex
Enantiomerically Pure Isophorone Diamine [3-(Aminomethyl)-3,5,5-trimethylcyclohexylamine]: A Chiral 1,4-Diamine Building Block Made Available on Large Scale
Journal of Organic Chemistry, 2006, 71, 9312-9318
4022251 CIFC13 H14 O2P c a b7.9339; 15.9909; 17.3091
90; 90; 90
2196Wolfgang Pitsch; Michael Klein; Manfred Zabel; Burkhard König
Synthesis and Structure of a Stabilized 10-Membered Cyclic Enediyne
Journal of Organic Chemistry, 2002, 67, 6805-6807
4022333 CIFC72 H116 Cl N3 Si4 ZnP c a b14.8345; 30.4586; 34.0301
90; 90; 90
15376.1Alexander Krivokapic; Andrew R. Cowley; Harry L. Anderson
Contracted and Expanded meso-Alkynyl Porphyrinoids: from Triphyrin to Hexaphyrin
Journal of Organic Chemistry, 2003, 68, 1089-1096
4023499 CIFC14 H22 N4 O3P c a b7.046; 15.999; 26.916
90; 90; 90
3034Ivan V. Korendovych; Mimi Cho; Olga V. Makhlynets; Phillip L. Butler; Richard J. Staples; Elena V. Rybak-Akimova
Anion and Carboxylic Acid Binding to Monotopic and Ditopic Amidopyridine Macrocycles
Journal of Organic Chemistry, 2008, 73, 4771-4782
4024917 CIFC18 H14 Br2P c a b8.1087; 11.577; 32.9287
90; 90; 90
3091.16Gon-Ann Lee; Wen-Chieh Wang; Shih-Fen Jiang; Chih-Yi Chang; Ru-Ting Tsai
The Crossed [2+2] Cycloaddition of 1-Phenylcyclopropene and 1-Bromo-2-phenylcyclopropene
Journal of Organic Chemistry, 2009, 74, 7994-7997
4024918 CIFC18 H12 Br2P c a b7.903; 11.57; 32.895
90; 90; 90
3007.84Gon-Ann Lee; Wen-Chieh Wang; Shih-Fen Jiang; Chih-Yi Chang; Ru-Ting Tsai
The Crossed [2+2] Cycloaddition of 1-Phenylcyclopropene and 1-Bromo-2-phenylcyclopropene
Journal of Organic Chemistry, 2009, 74, 7994-7997
4025118 CIFC27 H24 O2P c a b11.3164; 17.6548; 20.537
90; 90; 90
4103Liang-Feng Yao; Yin Wei; Min Shi
Silver- and Gold-Catalyzed Intramolecular Rearrangement of Propargylic Alcohols Tethered with Methylenecyclopropanes: Stereoselective Synthesis of Allenylcyclobutanols and 1-Vinyl-3-oxabicyclo[3.2.1]octan-8-one Derivatives
Journal of Organic Chemistry, 2009, 74, 9466-9469
4026188 CIFC22 H24 N2 O5 SP c a b10.0542; 18.2032; 23.872
90; 90; 90
4369Siang-en Syu; Yu-Ting Lee; Yeong-Jiunn Jang; Wenwei Lin
Organocatalytic Tandem Three-Component Reaction of Imine, Alkyl Vinyl Ketone, and Imide via aza-Baylis-Hillman Reaction
Journal of Organic Chemistry, 2011, 76, 2888-2891
4026613 CIFC32 H30 N2 O6P c a b7.6426; 22.219; 30.684
90; 90; 90
5210.5Prem N. Basa; Arundhati Bhowmick; Mariah M. Schulz; Andrew G. Sykes
Site-Selective Imination of an Anthracenone Sensor: Selective Fluorescence Detection of Barium(II)
Journal of Organic Chemistry, 2011, 76, 7866-7871

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