Crystallography Open Database

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1010922 CIFO4 Sb2P b n 214.804; 5.424; 11.76
90; 90; 90		306.4Dihlstroem, K
Ueber den Bau des wahren Antimontetroxyds und des damit isomorphen Stibiotantalits, Sb Ta O4
Zeitschrift fuer Anorganische und Allgemeine Chemie, 1938, 239, 57-64
1527631 CIFGe Na O4 SmP b n 215.27; 11.7; 6.5
90; 90; 90		400.783Kharakh, E.A.; Belov, N.V.; Chichagov, A.V.
Crystal structure of sodium samarium orthogermanate
Kristallografiya, 1970, 15, 1064-1065
1528593 CIFBa Co4 O6.95 YbP b n 216.25114; 10.89335; 10.18697
90; 90; 90		693.69Huq, A.; Stephens, P.W.; Zheng, H.; Chapon, L.C.; Mitchell, J.F.; Knight, K.S.; Radaelli, P.G.
Structural and magnetic properties of the Kagome antiferromagnet Yb Ba Co4 O7
Journal of Solid State Chemistry, 2006, 179, 1136-1145
1530632 CIFAl3 H4 Na3 O14 Si3P b n 2115.004; 16.464; 5.231
90; 90; 90		1292.19Ragimov, K.G.; Mamedov, Kh.S.; Mustafaev, N.M.; Chiragov, M.I.
Crystal structure of synthetic sodium-alumosilicate Na3 Al3 Si3 O12 (H2 O)2
Doklady Akademii Nauk SSSR, 1978, 242, 839-841
1530808 CIFI Na O3P b n 216.3959; 5.7475; 8.1286
90; 90; 90		298.811Sorokina, N.I.; Ilyukhin, V.V.; Pakhomov, V.I.; Belov, N.V.
About the crystal structure of sodium iodate
Doklady Akademii Nauk SSSR, 1979, 249, 613-616
1534336 CIFGa Nd O3P b n 215.44; 5.5; 7.71
90; 90; 90		230.683Brusset, H.; Berdot, J.L.; Gillier-Pandraud, H.
Structure cristalline du gallate de neodyme Nd Ga O3
Bulletin de la Societe Chimique de France (Vol=Year), 1967, 1967, 2886-2890
1535733 CIFC5 Cr O7 SP b n 216.578; 12.452; 21.77
90; 90; 90		1783.17Burschka, C.; Baumann, F.E.; Schenk, W.A.
Die Kristall- und Molekuelstruktur von Pentacarbonyl(schwefeldioxid)-chrom
Zeitschrift fuer Anorganische und Allgemeine Chemie, 1983, 502, 191-198
1542185 CIFH4 Li N O4 SeP b n 215.278; 17.346; 5.116
90; 90; 90		468.381Waskowska, A.; Allmann, R.
Ammonium lithium selenate, N H4 Li Se O4
Crystal Structure Communications, 1982, 11, 2029-2034
2000106 CIFC17 H25 N5 O2P b n 2110.734; 20.806; 7.625
90; 90; 90		1702.9Dutasta, J. P.; Gellon, G.; Pierre, J. L.; Averbuch-Pouchot, M. T.; Durif, A.
Structure of a pyridyl-containing macrobicyclic molecule, potential transition-metal complexing agent and NADH model precursor
Acta Crystallographica, Section C: Crystal Structure Communications, 1990, 46, 259-261
2000756 CIF
Paper		C25 H22 N2 O3P b n 219.385; 12.314; 18.573
90; 90; 90		2146.4Mostafa, G.; Mukherjee, M.; Ray, S.
Structure of <i>N</i>-benzyl-3-benzylidene-4-methyl-4-nitro-5-phenyl-2-pyrrolidinone
Acta Crystallographica Section C, 1992, 48, 1241-1243
2100159 CIF
Paper		B32 K16 Nb16 O96P b n 217.3056; 31.1632; 9.1659
90; 90; 90		2086.8Schmid, Siegbert; Wagner, Trixie
Structure of KNbOB~2~O~5~ ‒ a commensurately modulated structure
Acta Crystallographica Section B, 2005, 61, 361-366
2104810 CIF
HKL
Paper		C10 H26 Ni O15 S2P b n 2117.8198; 14.8945; 14.6052
90; 90; 90		3876.5Siegler, Maxime A.; Stavitski, Eli
On the sequence of three related phases of [Ni(H~2~O)~2~(15-crown-5)](HSO~4~)~2~ in the temperature range 110‒295K
Acta Crystallographica Section B, 2010, 66, 430-440
2105401 CIFB2 K Nb O6P b n 217.3056; 31.1632; 9.1659
90; 90; 90		2086.76Schmid, S.; Wagner, T.
Structure of K Nb O B2 O5 - a commensurately modulated structure
Acta Crystallographica B (39,1983-), 2005, 61, 361-366
2106912 CIFCa2 Nd4 O20 Ti6P b n 217.664; 36.64; 5.436
90; 90; 90		1526.48Nanot, M.; Queyroux, F.; Gilles, J.C.; Chevalier, R.
Structure cristalline du compose Nd4 Ca2 Ti6 O20, terne N ' 6 de la serie (Nd, Ca)n Tin O3n+2
Acta Crystallographica B (24,1968-38,1982), 1976, 32, 1115-1120
2211961 CIF
HKL
Paper		C14 H16 N2 O2P b n 217.0644; 7.577; 23.8053
90; 90; 90		1274.23Sema Öztürk Yıldırım; Mehmet Akkurt; Talat Özpozan; Frank W. Heinemann
Orthorhombic polymorph of 1,2-bis(2-aminophenoxy)ethane
Acta Crystallographica Section E, 2007, 63, o331-o332
2220397 CIF
HKL
Paper		C5 H8 O6 S2P b n 216.0489; 12.8431; 21.583
90; 90; 90		1676.7Rao, Zai-Ying; Xiao, Xin; Zhang, Yun-Qiang; Xue, Sai-Feng; Tao, Zhu
2,4,8,10-Tetraoxa-3,9-dithiaspiro[5.5]undecane 3,9-dioxide
Acta Crystallographica Section E, 2009, 65, o36
2222053 CIF
HKL
Paper		C16 H14 Cl F3 N2 O4 SP b n 219.1156; 14.1582; 27.6012
90; 90; 90		3562.2Mosslemin, Mohammad Hossein; Nateghi, Mohammad Reza; Sadoughi, Hesamaddin; Lamei, Asal
4-(4-Chlorophenyl)-6-hydroxy-5-(2-thienylcarbonyl)-6-(trifluoromethyl)-3,4,5,6-tetrahydropyrimidin-2(1<i>H</i>)-one monohydrate
Acta Crystallographica Section E, 2009, 65, o1339
2310530 CIFH5 Li N2 O4 SP b n 218.99; 9.94; 5.18
90; 90; 90		462.888Brown, I.D.
The Crystal Structure of Lithium Hydrazinium Sulfate
Acta Crystallographica (1,1948-23,1967), 1964, 17, 654-660
4000582 CIFC50 H29 B F24 N3 O3 ReP b n 2116.3679; 16.989; 18.9093
90; 90; 90		5258.19Chemistry of Materials, 2005
4066405 CIFC39 H88 N8 O5 Zn5P b n 219.8564; 20.8362; 25.8918
90; 90; 90		5317.4Hollingsworth, Nathan; Johnson, Andrew L.; Kingsley, Andrew; Kociok-Köhn, Gabriele; Molloy, Kieran C.
Structural Study of the Reaction of Methylzinc Amino Alcoholates with Oxygen
Organometallics, 2010, 29, 3318
4074162 CIFC14 H25 Br N2 NiP b n 219.686; 11.236; 14.713
90; 90; 90		1601.2Silva, Leonel C.; Gomes, Pedro T.; Veiros, Luis F.; Pascu, Sofia I.; Duarte, M. Teresa; Namorado, Sónia; Ascenso, José R.; Dias, Alberto R.
Synthesis, Structure, and Solution Dynamics of Neutral Allylnickel Complexes of N-Heterocyclic Carbenes
Organometallics, 2006, 25, 4391
4079334 CIFC22 H26 B N7 O RuP b n 219.027; 16.176; 16.069
90; 90; 90		2346.41Lo, Yih-Hsing; Wang, Tsang-Hsiu; Lee, Chia-Yi; Feng, Ying-Hsuan
Preparation, Characterization, and Reactivity of Azido Complex Containing a Tp(tBuNC)(PPh3)Ru Fragment and Ruthenium-Catalyzed Cycloaddition of Organic Azides with Alkynes in Organic and Aqueous Media
Organometallics, 2012, 31, 6887
4082508 CIFC14 H29 Mn O P2P b n 2110.2957; 12.8814; 13.1551
90; 90; 90		1744.67de la Cruz Cruz, José Ignacio; Juárez-Saavedra, Patricia; Paz-Michel, Brenda; Leyva-Ramirez, Marco Antonio; Rajapakshe, Asha; Vannucci, Aaron K.; Lichtenberger, Dennis L.; Paz-Sandoval, M. Angeles
Phosphine-Substituted (η5-Pentadienyl) Manganese Carbonyl Complexes: Geometric Structures, Electronic Structures, and Energetic Properties of the Associative Substitution Mechanism, Including Isolation of the Slipped η3-Pentadienyl Associative Intermediate
Organometallics, 2014, 33, 278
4117124 CIFC15 H17 N O2P b n 2114.645; 15.402; 6.142
90; 90; 90		1385.4Kazushi Kinbara; Yukihiko Hashimoto; Makoto Sukegawa; Hiroyuki Nohira; Kazuhiko Saigo
Crystal Structures of the Salts of Chiral Primary Amines with Achiral Carboxylic Acids: Recognition of the Commonly-Occurring Supramolecular Assemblies of Hydrogen-Bond Networks and Their Role in the Formation of Conglomerates
Journal of the American Chemical Society, 1996, 118, 3441-3449
4117131 CIFC18 H21 N O2P b n 2110.541; 26.326; 5.831
90; 90; 90		1618.1Kazushi Kinbara; Yukihiko Hashimoto; Makoto Sukegawa; Hiroyuki Nohira; Kazuhiko Saigo
Crystal Structures of the Salts of Chiral Primary Amines with Achiral Carboxylic Acids: Recognition of the Commonly-Occurring Supramolecular Assemblies of Hydrogen-Bond Networks and Their Role in the Formation of Conglomerates
Journal of the American Chemical Society, 1996, 118, 3441-3449
4119659 CIFC41 H55 N3 O3P b n 218.8939; 19.0851; 44.15
90; 90; 90		7494.1Valeria Amendola; Greta Bergamaschi; Massimo Boiocchi; Luigi Fabbrizzi; Lorenzo Mosca
The Interaction of Fluoride with Fluorogenic Ureas: An ON1-OFF-ON2 Response
Journal of the American Chemical Society, 2013, 135, 6345-6355
4120504 CIFC6 H N2 O S4P b n 2113.211; 15.162; 3.3733
90; 90; 90		675.7Wong, Joanne W. L.; Mailman, Aaron; Lekin, Kristina; Winter, Stephen M.; Yong, Wenjun; Zhao, Jianbao; Garimella, Subrahmanyam V.; Tse, John S.; Secco, Richard A.; Desgreniers, Serge; Ohishi, Yasuo; Borondics, Ferenc; Oakley, Richard T.
Pressure induced phase transitions and metallization of a neutral radical conductor.
Journal of the American Chemical Society, 2014, 136, 1070-1081
4120505 CIFC6 H N2 O S4P b n 2112.8799; 14.888; 3.2737
90; 90; 90		627.8Wong, Joanne W. L.; Mailman, Aaron; Lekin, Kristina; Winter, Stephen M.; Yong, Wenjun; Zhao, Jianbao; Garimella, Subrahmanyam V.; Tse, John S.; Secco, Richard A.; Desgreniers, Serge; Ohishi, Yasuo; Borondics, Ferenc; Oakley, Richard T.
Pressure induced phase transitions and metallization of a neutral radical conductor.
Journal of the American Chemical Society, 2014, 136, 1070-1081
4120506 CIFC6 H N2 O S4P b n 2113.001; 14.9086; 2.99495
90; 90; 90		580.5Wong, Joanne W. L.; Mailman, Aaron; Lekin, Kristina; Winter, Stephen M.; Yong, Wenjun; Zhao, Jianbao; Garimella, Subrahmanyam V.; Tse, John S.; Secco, Richard A.; Desgreniers, Serge; Ohishi, Yasuo; Borondics, Ferenc; Oakley, Richard T.
Pressure induced phase transitions and metallization of a neutral radical conductor.
Journal of the American Chemical Society, 2014, 136, 1070-1081
4120507 CIFC6 H N2 O S4P b n 2113.0632; 14.9449; 3.02303
90; 90; 90		590.18Wong, Joanne W. L.; Mailman, Aaron; Lekin, Kristina; Winter, Stephen M.; Yong, Wenjun; Zhao, Jianbao; Garimella, Subrahmanyam V.; Tse, John S.; Secco, Richard A.; Desgreniers, Serge; Ohishi, Yasuo; Borondics, Ferenc; Oakley, Richard T.
Pressure induced phase transitions and metallization of a neutral radical conductor.
Journal of the American Chemical Society, 2014, 136, 1070-1081
4120508 CIFC6 H N2 O S4P b n 2112.9187; 14.8422; 2.96191
90; 90; 90		567.92Wong, Joanne W. L.; Mailman, Aaron; Lekin, Kristina; Winter, Stephen M.; Yong, Wenjun; Zhao, Jianbao; Garimella, Subrahmanyam V.; Tse, John S.; Secco, Richard A.; Desgreniers, Serge; Ohishi, Yasuo; Borondics, Ferenc; Oakley, Richard T.
Pressure induced phase transitions and metallization of a neutral radical conductor.
Journal of the American Chemical Society, 2014, 136, 1070-1081
4300730 CIFC22 H36 B Li N6 O4 S3P b n 2113.7303; 14.6919; 14.7425
90; 90; 90		2973.92Inorganic Chemistry, 2006
4315021 CIFC54 H59 Cl10 Cu3 N15 O3P b n 2110.3007; 23.61; 26.996
90; 90; 90		6565.4Mrituanjay D. Pandey; Ashutosh Kumar Mishra; Vadapalli Chandrasekhar; Sandeep Verma
Silver-Guided Excimer Emission in an Adenine-Pyrene Conjugate: Fluorescence Lifetime and Crystal Studies
Inorganic Chemistry, 2010, 49, 2020-2022
4317504 CIFC92 H90 N12 O8 P4 Rh2P b n 2112.537; 18.113; 38.231
90; 90; 90		8682G. Attilio Ardizzoia; Stefano Brenna; Girolamo LaMonica; Angelo Maspero; Norberto Masciocchi; Massimo Moret
Oxidative Addition of N-H Bonds to a Metal Center: Synthesis, Characterization, and Crystal Structure of New Rhodium(III) Hydrido-Pyrazolate Complexes
Inorganic Chemistry, 2002, 41, 610-614
4322996 CIFC12 H30 Cl4 Eu O9P b n 2110.232; 14.7449; 29.9123
90; 90; 90		4512.86Hany Hassaballa; Jonathan W. Steed; Peter C. Junk; Mark R. J. Elsegood
Formation of Lanthanide and Actinide Oxonium Ion Complexes with Crown Ethers from a Liquid Clathrate Medium
Inorganic Chemistry, 1998, 37, 4666-4671
4330277 CIF
HKL		Bi23.346 Cu4.654 Li4 O72 P12P b n 2111.4096; 5.4333; 25.1315
90; 90; 90		1557.95Diana Endara; Marie Colmont; Marielle Huvé; Frederic Capet; Julien Lejay; P. Aschehoug; Olivier Mentre
Inorganic Polar Blocks into Controlled Acentric Assemblies
Inorganic Chemistry, 2012, 51, 9557-9562
4505849 CIFC6 H18 Co N5 O4P b n 218.0875; 11.677; 12.218
90; 90; 90		1153.8Chun, Hyungphil; Bernal, Ivan
Crystal Structures of Neutral Cobalt(III) Complexes: Common Hydrogen-Bonding Patterns Observed in Compounds of Different Molecular Structures
Crystal Growth & Design, 2001, 1, 143
7007432 CIFC13 H15 B Fe O2P b n 215.8359; 13.84; 14.7344
90; 90; 90		1190.08Bresner, Christopher; Day, Joanna K.; Coombs, Natalie D.; Fallis, Ian A.; Aldridge, Simon; Coles, Simon J.; Hursthouse, Michael B.
Fluoride anion binding by cyclic boronic esters: influence of backbone chelate on receptor integrity.
Dalton transactions (Cambridge, England : 2003), 2006, 3660-3667
7008025 CIFC21 H42 Cl4 O2 P2 RuP b n 219.447; 16.15; 18.484
90; 90; 90		2820.09Goicoechea, Jose M.; Mahon, Mary F.; Whittlesey, Michael K.; Kumar, P. G. Anil; Pregosin, Paul S.
Mononuclear and dinuclear complexes with a [Ru(tBu2PCH2CH2PtBu2)(CO)] core.
Dalton transactions (Cambridge, England : 2003), 2005, 588-597
7012886 CIFC16 H10 Ag B F4 N2P b n 215.7422; 13.686; 18.32
90; 90; 90		1439.7Haftbaradaran, Farzad; Draper, Neil D.; Leznoff, Daniel B.; Williams, Vance E.
Strained silver(i) coordination polymers of 1,4-diazatriphenylene
Dalton Transactions, 2003, 2105
7018945 CIFC28 H35 Cl Cu4 N4 O15P b n 217.9039; 15.7253; 27.7552
90; 90; 90		3449.73Chakraborty, Anindita; Gurunatha, K. L.; Muthulakshmi, A.; Dutta, Sudipta; Pati, Swapan K.; Maji, Tapas Kumar
Assembly of trinuclear and tetranuclear building units of Cu(2+) towards two 1D magnetic systems: synthesis and magneto-structural correlations.
Dalton transactions (Cambridge, England : 2003), 2012, 41, 5879-5888
7024508 CIFC22 H33 F6 N4 Ni O PP b n 218.4631; 15.9967; 18.1177
90; 90; 90		2452.8Santana, M. Dolores; García-Bueno, Rocío; García, Gabriel; Pérez, José; García, Luis; Monge, Miguel; Laguna, Antonio
Luminescence of five-coordinated nickel(ii) complexes with substituted-8-hydroxyquinolines and macrocyclic ligands.
Dalton transactions (Cambridge, England : 2003), 2010, 39, 1797-1806
7026288 CIFC28 H45 Li N O2 PP b n 2110.7145; 15.3867; 17.6868
90; 90; 90		2915.86Liang, Lan-Chang; Lee, Wei-Ying; Tsai, Tzung-Ling; Hsu, Yu-Lin; Lee, Ting-Yu
Amido phosphine complexes of zinc: synthesis, structure, and catalytic ring-opening polymerization of epsilon-caprolactone.
Dalton transactions (Cambridge, England : 2003), 2010, 39, 8748-8758
7030831 CIFC12 H12 Cu N6 S2P b n 2115.6369; 15.6322; 6.3057
90; 90; 90		1541.4Wang, Bao-Ying; Xu, Wei-Jian; Xue, Wei; Lin, Rui-Biao; Du, Zi-Yi; Zhou, Dong-Dong; Zhang, Wei-Xiong; Chen, Xiao-Ming
Restraining the motion of a ligand for modulating the structural phase transition in two isomorphic polar coordination polymers.
Dalton transactions (Cambridge, England : 2003), 2014, 43, 9008-9011
7044903 CIFC18 H8 Ba N8 O3P b n 216.832; 13.8221; 21.1263
90; 90; 90		1995.01Nimax, Patrick R.; Sünkel, Karlheinz
Structural diversity in the alkaline earth metal compounds of tetra and pentacyanocyclopentadienide.
Dalton transactions (Cambridge, England : 2003), 2018, 47, 409-417
7054611 CIFC102 H95 Al4 Cl8 N4 O8P b n 2112.0601; 22.5938; 35.5013
90; 90; 90		9673.5Forder, Thomas R.; Jones, Matthew D.
Synthesis and characterisation of aluminium(iii) imine bis(phenolate) complexes with application for the polymerisation of rac-LA
New J. Chem., 2015, 39, 1974
7057635 CIFC22 H23 N2 O5 SP b n 219.278; 11.646; 39.24
90; 90; 90		4240Viqueira, Joaquín; Durán, María L.; García-Vázquez, José A.; Castro, Jesús; Platas-Iglesias, Carlos; Esteban-Gómez, David; Alzuet-Piña, Gloria; Moldes, Angeles; Nascimento, Otaciro R.
Modulating the DNA cleavage ability of copper(ii) Schiff bases through ternary complex formation
New Journal of Chemistry, 2018, 42, 15170
7104005 CIFC14 H36 Cl3 Co N6 O16P b n 2111.696; 14.532; 16.561
90; 90; 90		2815Ivan Bernal; Manas K. Saha
An unprecedented trans-Oriented product fro the Cleavage of a Dipeptide
Chemical communications (Cambridge, England), 2003
7109033 CIFC45 H51 N O4P b n 219.4797; 19.1121; 41.8099
90; 90; 90		7575Jan Holub; Vaclav Eigner; Lukas Vrzal; Hana Dvorakova; Pavel Lhotak
Calix[4]arenes with intramolecularly bridged meta positions prepared via Pd-catalysed double C-H activation
Chem.Commun., 2013, 49, 2798
7223123 CIFC34.9 H47.6 N2 O8.9P b n 2110.7741; 11.3507; 28.2413
90; 90; 90		3453.73Stepanovs, D.; Jure, M.; Yanichev, A.; Belyakov, S.; Mishnev, A.
Molecular salts of propranolol with dicarboxylic acids: diversity of stoichiometry, supramolecular structures and physicochemical properties
CrystEngComm, 2015, 17, 9023

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