Crystallography Open Database

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2202612 CIF
HKL
Paper
C24 H27 N O4P c a 2114.08; 15.158; 20.233
90; 90; 90
4318.2Yuling Li; Xiangshan Wang; Daqing Shi; Baixiang Du; Shujiang Tu
3,3,6,6-Tetramethyl-9-(3,4-methylenedioxylphenyl)-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione
Acta Crystallographica Section E, 2003, 59, o1446-o1448
2202837 CIF
HKL
Paper
C18 H23 Co N6 O S3P c a 2116.969; 8.0436; 16.552
90; 90; 90
2259.2Burrow, Robert Alan; Schulz Lang, Ernesto; Fernandes Jr, Ramão Marceli; Vázquez-López, Ezequiel M.
A new polymorph of <i>fac</i>-tris(4,6-dimethylpyrimidine-2-thiolato-κ^2^<i>N,S</i>)cobalt(III) monohydrate
Acta Crystallographica Section E, 2003, 59, m396-m398
2203032 CIF
HKL
Paper
C12 H29 Cl5 Cu3 N4P c a 2115.5111; 11.0313; 12.7192
90; 90; 90
2176.4Butcher, Ray J.; George, C.; Purdy, Andrew P.
Tetra-μ-chloro-chloro(<i>N,N,N</i>',<i>N</i>'-tetramethylethane-1,2-diamine)(1,1,3-trimethyl-2-imidazolium)dicopper(I)copper(II)
Acta Crystallographica Section E, 2004, 60, m102-m104
2203266 CIF
HKL
Paper
C15 H13 N3P c a 2110.7227; 11.0789; 10.1268
90; 90; 90
1203Seshadri, Tarimala; Flörke, Ulrich; Henkel, Gerald
<i>N</i>-(8-Quinolyl)-<i>o</i>-phenylenediamine
Acta Crystallographica Section E, 2004, 60, o399-o400
2203313 CIF
HKL
Paper
C13 H11 N OP c a 2114.3555; 4.4969; 31.4473
90; 90; 90
2030.09Glidewell, Christopher; Low, John N.; Skakle, Janet M. S.; Wardell, James L.
(<i>E</i>)-2-Phenylbenzaldehyde oxime forms hydrogen-bonded <i>C</i>~2~^2^(6) chains
Acta Crystallographica Section E, 2004, 60, o422-o424
2203423 CIF
Paper
C22 H20 N2 O3P c a 219.9819; 22.3639; 8.415
90; 90; 90
1878.52Weiming Xu; Xiu-Rong Hu; Jian-Ming Gu; Xian Huang
5-{2-[3-(4-Methoxyphenyl)-4,5-dihydroisoxazol-5-yl]vinyl}-3-<i>p</i>-tolylisoxazole
Acta Crystallographica Section E, 2004, 60, o676-o677
2203758 CIF
HKL
Paper
C18 H16 F N3P c a 2118.0843; 8.198; 21.469
90; 90; 90
3182.9Kazak, Canan; Yilmaz, Veysel T.; Goker, Hakan; Kus, Canan
1-<i>n</i>-Butyl-2-(4'-fluorophenyl)-1<i>H</i>-benzimidazole-6-carbonitrile
Acta Crystallographica Section E, 2004, 60, m819-m821
2203811 CIF
HKL
Paper
C10 H13 Br Cu N2 O5P c a 219.442; 5.063; 27.926
90; 90; 90
1335Bakir, Mohammed; Clarke, Suzanne A.; Hassan, Ishmael; Lancashire, Robert J.; Singh-Wilmot, Marvadeen
<i>trans</i>-Bis(glycinato-κ^2^<i>N,O</i>)copper(II) 4-bromophenol solvate
Acta Crystallographica Section E, 2004, 60, m868-m870
2203885 CIF
HKL
Paper
C16 H30 Cl Cr K O9P c a 2114.693; 9.221; 16.515
90; 90; 90
2237.5Kotlyar, Sergey A.; Zubatyuk, Roman I.; Shishkin, Oleg V.; Chuprin, Gennady N.; Kiriyak, Andrey V.; Kamalov, Gerbert L.
(<i>cis</i>-Cyclohexano-18-crown-6)potassium chlorochromate(VI)
Acta Crystallographica Section E, 2004, 60, m1015-m1016
2204105 CIF
Paper
C19 H14 F I N2 O4P c a 219.613; 11.759; 16.571
90; 90; 90
1873.1Hou, Zhong-Ke; Ren, Ye-Guo; Huang, Ming-Zhi; Song, Jian; Chen, Li-Gong
2-[7-Fluoro-3,4-dihydro-4-(3-iodoprop-2-ynyl)-3-oxo-2H-1,4-benzoxazin-6-yl]- 4,5,6,7-tetrahydro-2H-isoindole-1,3-dione
Acta Crystallographica, Section E, 2004, 60, o1335-o1336
2204109 CIF
HKL
Paper
C4 H9 Mn N O6P c a 2114.535; 5.34; 9.731
90; 90; 90
755.3Zhang, Quan-Zheng; Lu, Can-Zhong
<i>catena</i>-Poly[[diaquamanganese(II)]-μ-iminodiacetato-κ^4^<i>O,N,O</i>':<i>O</i>'']
Acta Crystallographica Section E, 2004, 60, m1189-m1190
2204145 CIF
HKL
Paper
C14 H15 Cl N2 O6P c a 2130.983; 4.92; 9.981
90; 90; 90
1521.5Zhao, Hui; Huo, Li-Hua; Gao, Shan; Zhang, Zhu-Yan; Zhao, Jing-Gui; Ng, Seik Weng
1-Carboxymethyl-3-hydroxypyridinium chloride–3-hydroxypyridinium-1-acetate (1/1)
Acta Crystallographica Section E, 2004, 60, o1501-o1503
2204187 CIF
Paper
C22 H28 Cl2 Co N4 O2P c a 2117.5842; 7.6235; 17.8892
90; 90; 90
2398.1Türktekin, Sevim; Akkurt, Mehmet; Orhan, Ersin; Küçükbay, F. Zehra; Küçükbay, Hasan; Büyükgüngör, Orhan
Dichlorobis[1-(2-ethoxyethyl)-1<i>H</i>-benzimidazole-κ<i>N</i>^3^]cobalt(II)
Acta Crystallographica Section E, 2004, 60, m1220-m1222
2204200 CIF
HKL
Paper
C15 H16 N2 SP c a 2118.1809; 10.6493; 6.847
90; 90; 90
1325.67Sonar, Vijayakumar N.; Parkin, Sean; Crooks, Peter A.
4-(Benzo[<i>b</i>]thiophen-3-yl)-1-methylpiperidine-4-carbonitrile
Acta Crystallographica Section E, 2004, 60, o1533-o1534
2204230 CIF
HKL
Paper
C18 H12 N3 O7 PP c a 2119.1402; 5.4608; 16.8888
90; 90; 90
1765.23Jean-Noël, Gregory; Fronczek, Frank R.; Isovitsch, Ralph
Tris(3-nitrophenyl)phosphine oxide
Acta Crystallographica Section E, 2004, 60, o1646-o1647
2204477 CIF
HKL
Paper
C8 H5 Cs O4P c a 2110.659; 12.768; 6.556
90; 90; 90
892.2Mancheng Hu; Chunyu Geng; Shuni Li; Zhihong Liu; Yucheng Jiang; Guofang Zhang
Caesium(I) hydrogen phthalate
Acta Crystallographica Section E, 2004, 60, m1713-m1715
2204505 CIF
HKL
Paper
C4 H9 Mn N O6P c a 2114.5818; 5.3508; 9.7958
90; 90; 90
764.31Bing-Xin Liu; Duan-Jun Xu
Redetermination of <i>catena</i>-poly[[diaquamanganese(II)]-μ-iminodiacetato-κ^4^<i>N</i>,<i>O</i>,<i>O</i>':<i>O</i>'']
Acta Crystallographica Section E, 2004, 60, m1570-m1572
2204523 CIF
HKL
Paper
C22 H23 Fe N3 OP c a 2110.165; 14.205; 13.262
90; 90; 90
1915Jin, Zhong; Song, Hai-bing; Liu, Wei; Hu, Yan; Liu, Jian-bin; Shao, Ling; Fang, Jian-xin
1-(1-Ferrocenyl-1-methoxy-3-phenyl-2-propyl)-1<i>H</i>-1,2,4-triazole
Acta Crystallographica Section E, 2004, 60, m1692-m1694
2204747 CIF
HKL
Paper
C10 H11 Cl N4P c a 218.776; 11.78; 10.645
90; 90; 90
1100.5Chopra, Deepak; Mohan, T. P.; Rao, K. S.; Guru Row, T. N.
(<i>E</i>)-<i>N</i>^1^-[(6-Chloropyridin-3-yl)methyl]-<i>N</i>^2^-cyano-<i>N</i>^1^-methylacetamidine
Acta Crystallographica Section E, 2004, 60, o2374-o2375
2204878 CIF
HKL
Paper
C19 H20 N4P c a 2112.535; 7.856; 16.253
90; 90; 90
1600.5Rozycka-Sokolowska, Ewa; Girek, Tomasz; Marciniak, Bernard; Pavlyuk, Volodymyr; Drabowicz, Jozef; Matsumoto, Kyoshi
5-(<i>N</i>,<i>N</i>-Diethylamino)-4,6-diphenyl-1,2,3-triazine
Acta Crystallographica Section E, 2005, 61, o93-o95
2204893 CIF
Paper
C22 H28 Cl2 N4 Ni O2P c a 2117.416; 7.624; 17.667
90; 90; 90
2345.8Mehmet Akkurt; Selvi Karaca; Hasan Küçükbay; Ersin Orhan; Orhan Büyükgüngör
Dichlorobis[1-(2-ethoxyethyl)-1<i>H</i>-benzimidazole-κ<i>N</i>^3^]nickel(II)
Acta Crystallographica Section E, 2005, 61, m41-m43
2205109 CIF
HKL
Paper
C14 H14 O3 SP c a 2127.612; 7.947; 5.977
90; 90; 90
1311.5Vadivelu Manivannan; Nagarajan Vembu; Maruthai Nallu; Kandasamy Sivakumar; Fronczek, Frank R.
4-Methylphenyl 4-toluenesulfonate: supramolecular aggregation through weak C—H···O and C—H···π interactions
Acta Crystallographica Section E, 2005, 61, o242-o244
2205111 CIF
Paper
C10 H8 N2 O4 SP c a 2124.321; 5.0468; 8.6066
90; 90; 90
1056.4Yathirajan, Hemmige S.; Rai, Kuriya M. Lokanatha; Gaonkar, Santhosh L.; Narasegowda, Rajenahally S.; Prabhuswamy, Basappa; Bolte, Michael
3-(<i>p</i>-Nitrobenzyl)-1,3-thiazolidine-2,4-dione
Acta Crystallographica Section E, 2005, 61, o245-o246
2205140 CIF
HKL
Paper
C13 H10 Br2 O2P c a 2117.032; 3.9694; 35.819
90; 90; 90
2421.6Hussain, Zakir; Oeser, Thomas; Hopf, Henning
Ethyl 1,3-dibromoazulene-6-carboxylate
Acta Crystallographica Section E, 2005, 61, o478-o479
2205141 CIF
HKL
Paper
C25 H13 N3 O2P c a 2112.2243; 19.1241; 8.5207
90; 90; 90
1992Is̨ik, S̨amil; Yavuz, Metin; Akdemir, Nesuhi; Ağar, Erbil; Özil, Musa
12,13-Dihydro-12-oxo-13-phenylbenzo[<i>b</i>]naphth[<i>f</i>][1,4]oxazepine-2,3-dicarbonitrile
Acta Crystallographica Section E, 2005, 61, o427-o428
2205254 CIF
HKL
Paper
C13 H12 O3 SP c a 2125.149; 7.976; 5.916
90; 90; 90
1186.7Vadivelu Manivannan; Nagarajan Vembu; Maruthai Nallu; Kandasamy Sivakumar; Anthony Linden
Phenyl 4-toluenesulfonate: supramolecular aggregation through weak C—H···O and C—H···π interactions
Acta Crystallographica Section E, 2005, 61, o690-o692
2205503 CIF
HKL
Paper
C18 H15 Cl4 N5 O SP c a 2111.3496; 18.016; 10.9165
90; 90; 90
2232.1Fang, Xiao-Niu; Zhong, Fan; Dai, Mei-Zhen; Hu, Rong-Hua
3-(2,4-Dichlorophenyl)-4-[(1<i>E</i>)-(2,4-dichlorophenyl)methyleneamino]-4,5-dihydro-1<i>H</i>-1,2,4-triazole-5-thione dimethylformamide solvate
Acta Crystallographica Section E, 2005, 61, o863-o865
2205603 CIF
HKL
Paper
C12 H14 Br N3 O S ZnP c a 2111.75; 7.41; 33.842
90; 90; 90
2946.5Yue, Guo-Ren; Lei, Xin-You; Xu, Xin-Jian; Xue, Guo-Qing
<i>catena</i>-Poly[[[4-bromo-2-(2-dimethylaminoethyliminomethyl)phenolato]zinc(II)]-μ-thiocyanato]
Acta Crystallographica Section E, 2005, 61, m722-m724
2205612 CIF
Paper
Cs2 O15 Si6 ThP c a 2116.292; 7.2154; 13.68
90; 90; 90
1608.1Woodward, Jonathan D.; Almond, Philip M.; Albrecht-Schmitt, Thomas E.
Caesium thorium silicate, Cs~2~ThSi~6~O~15~
Acta Crystallographica, Section E, 2005, 61, i58-i60
2205661 CIF
HKL
Paper
C26 H19 O2 PP c a 2119.386; 5.584; 17.928
90; 90; 90
1940.7Qing-Xiang Liu; Hai-bin Song
9-Oxo-10-diphenylphosphinoylanthracene
Acta Crystallographica Section E, 2005, 61, o1489-o1490
2205883 CIF
HKL
Paper
C10 H20 Ca N2 O11P c a 2115.194; 15.908; 13.227
90; 90; 90
3197Brown, Michael D.; Levason, William; Webster, Michael
Bis(nitrato-κ^2^<i>O,O</i>')(1,4,7,10,13-pentaoxacyclopentadecane)calcium(II)
Acta Crystallographica Section E, 2005, 61, m1015-m1017
2205928 CIF
HKL
Paper
C34 H28 Cd N4 O5P c a 2115.096; 6.1108; 32.164
90; 90; 90
2967.1Gao, Shan; Liu, Ji-Wei; Huo, Li-Hua
<i>catena</i>-Poly[[aquacadmium(II)]bis(μ-4,5-diphenyl-1<i>H</i>-imidazole-1-acetate)-κ^3^<i>N</i>:<i>O</i>,<i>O</i>';κ^3^<i>O</i>,<i>O</i>':<i>N</i>]
Acta Crystallographica Section E, 2005, 61, m1012-m1014
2206069 CIF
HKL
Paper
C19 H18 N6 O2 SP c a 219.8596; 23.584; 8.4499
90; 90; 90
1964.8Sancak, Kemal; Çoruh, Ufuk; Ünver, Yasemin; Vázquez-López, Ezequiel M.
1-(Benzoylmethyl)-4-(3,5-dimethyl-4<i>H</i>-1,2,4-triazol-4-yl)-3-(2-thienylmethyl)-1<i>H</i>-1,2,4-triazol-5(4<i>H</i>)-one
Acta Crystallographica Section E, 2005, 61, o1785-o1787
2206177 CIF
HKL
Paper
C11 H10 N4 O3P c a 2126.334; 4.5962; 9.57
90; 90; 90
1158.3Jun Wan; Chun-Li Li; Xue-Mei Li; Ying Li; Shu-Sheng Zhang; Hong Xu; Ping-Kai Ouyang
1-(3-Nitrophenyl)-3-(1<i>H</i>-1,2,4-triazol-1-yl)propan-1-one
Acta Crystallographica Section E, 2005, 61, o1997-o1998
2206199 CIF
HKL
Paper
C8 H18 Cl4 Cu N2P c a 2119.6572; 8.0741; 17.6413
90; 90; 90
2799.9Sun, Xian-Ming; Qu, Yang
1,4-Dimethyl-1,4-diazoniabicyclo[2.2.2]octane tetrachlorocuprate(II)
Acta Crystallographica Section E, 2005, 61, m1360-m1362
2206258 CIF
HKL
Paper
C26 H26 N2 O3P c a 2111.9675; 11.066; 32.7891
90; 90; 90
4342.3Rosica Petrova; Boris Shivachev; Krasimir Kosev; Malinka Stoyanova; Silvia Angelova
(3<i>RS</i>,4<i>RS</i>)-3-(2-Furyl)-2-phenethyl-4-(pyrrolidin-1-ylcarbonyl)-3,4-dihydroisoquinolin-1(2<i>H</i>)-one
Acta Crystallographica Section E, 2005, 61, o2248-o2250
2206280 CIF
HKL
Paper
C14 H12 N4 S2P c a 2121.883; 8.7246; 7.2407
90; 90; 90
1382.4Yu, Yun; Yang, Kai-Bin; Lin, Li-Rong; Huang, Rong-Bin; Zheng, Lan-Sun
7-Amino-3-(3-aminophenyl)-1<i>H</i>-quinazoline-2,4-dithione
Acta Crystallographica Section E, 2005, 61, o2310-o2311
2206281 CIF
HKL
Paper
C37 H41 Cl Fe N2 Ni O2 P2 S3P c a 2120.6025; 12.4769; 29.709
90; 90; 90
7636.9Duff, S. E.; Hitchcock, P. B.; Davies, S. C.; Barclay, J. E.; Evans, D. J.
1,3-Bis(diphenylphosphino)propane-2κ^2^<i>P</i>,<i>P</i>'-dicarbonyl-1κ^2^<i>C</i>-chloro-2κ<i>Cl</i>-{μ-2,2',2''-nitrilotriethanethiolato(3‒)-1κ^4^<i>N</i>,<i>S</i>,<i>S</i>',<i>S</i>'':2κ^2^<i>S</i>,<i>S</i>'}iron(II)nickel(II) acetonitrile solvate
Acta Crystallographica Section E, 2005, 61, m1316-m1319
2206394 CIF
HKL
Paper
C12 H13 N3 OP c a 2110.943; 13.777; 7.514
90; 90; 90
1132.8Jun Wan; Chun-Li Li; Xue-Mei Li; Shi-Ying Wang; Shu-Sheng Zhang
1-(4-Methylphenyl)-3-(1<i>H</i>-1,2,4-triazol-1-yl)propan-1-one
Acta Crystallographica Section E, 2005, 61, o2391-o2392
2206487 CIF
HKL
Paper
C14 H10 I N3 O3P c a 2121.6122; 5.0393; 12.7868
90; 90; 90
1392.61Glidewell, Christopher; Low, John N.; Wardell, James L.
2-Nitrobenzaldehyde 2-iodobenzoylhydrazone
Acta Crystallographica Section E, 2005, 61, o2438-o2440
2206497 CIF
HKL
Paper
C14 H12 Cl N OP c a 2118.363; 5.2852; 12.509
90; 90; 90
1214Anilkumar, Haleyur G.; Yathirajan, Hemmige S.; Nagaraja, Padmarajaiah; Bolte, Michael
(2-Chloroanilino)acetophenone
Acta Crystallographica Section E, 2005, 61, o2551-o2552
2206617 CIF
HKL
Paper
C12 H18 N4 O7P c a 2121.9799; 6.9727; 20.77
90; 90; 90
3183.2Chellamuthu Muthamizhchelvan; Kolandaivelu Saminathan; Krishnan SethuSankar; Jan Fraanje; Rene Peschar; Kandasamy Sivakumar
Triethylaminium picrate
Acta Crystallographica Section E, 2005, 61, o2987-o2989
2206648 CIF
HKL
Paper
C14 H12 N2 O2P c a 2113.413; 13.115; 7.104
90; 90; 90
1249.7Wen Yang; Yan Zhang; De-Chun Zhang
<i>N</i>-(3-Nitrobenzylidene)-<i>p</i>-toluidine
Acta Crystallographica Section E, 2005, 61, o2964-o2966
2206722 CIF
HKL
Paper
C23 H21 Cl N2 O2 SP c a 2124.727; 10.2755; 8.2037
90; 90; 90
2084.4Anilkumar, G. N.; Kokila, M. K.; Puttaraja; Mohan, S.; Manjunath Shetty, K. S.
<i>N</i>-(2-Chlorophenyl)-2-{[(1<i>E</i>)-(4-methoxyphenyl)methylene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Acta Crystallographica Section E, 2005, 61, o3038-o3040
2206810 CIF
HKL
Paper
K4 Nb1.04 S11 Ta0.96P c a 2113.1554; 7.452; 17.9508
90; 90; 90
1759.79Yuandong Wu; Christian Näther; Wolfgang Bensch
K~4~Nb~0.96~Ta~1.04~S~11~
Acta Crystallographica Section E, 2005, 61, i208-i210
2207013 CIF
HKL
Paper
C14 H11 N3 O4P c a 2130.224; 4.8017; 8.7257
90; 90; 90
1266.33Ali, Hapipah M.; Puvaneswary, Subramaniam; Ng, Seik Weng
5-Nitrosalicylaldehyde benzoylhydrazone
Acta Crystallographica Section E, 2005, 61, o3464-o3465
2207032 CIF
HKL
Paper
C28 H34 O12P c a 2114.873; 7.9521; 23.763
90; 90; 90
2810.5Meng, Xiang-Gao; Wu, An-Xin
(2<i>RS</i>,3<i>SR</i>)-Diethyl 2,3-bis(3,4,5-trimethoxybenzoyl)succinate
Acta Crystallographica Section E, 2005, 61, o3117-o3118
2207096 CIF
HKL
Paper
C14 H20 N2 O5P c a 218.3002; 20.6868; 8.5584
90; 90; 90
1469.52Simonov, Yurii A.; Gonta, Maria V.; Yavolovskii, Arkadii A.
11-Nitroso-6,7,10,11,12,13,15,16-octahydro-9<i>H</i>-5,8,14,17-tetraoxa-11-azabenzocyclopentadecene
Acta Crystallographica Section E, 2005, 61, o3136-o3139
2207156 CIF
HKL
Paper
C14 H15 Cl2 Fe N2 O2P c a 2119.428; 7.0016; 11.5352
90; 90; 90
1569.1Jin-Hua Zhang; Jun Li; Feng-Xing Zhang; Ng, Seik Weng
Dichloro(methanol-κ<i>O</i>)[2-(2-pyridylmethyliminomethyl)phenolato-κ^3^<i>N</i>,<i>N</i>',<i>O</i>]iron(III)
Acta Crystallographica Section E, 2005, 61, m2338-m2339
2207172 CIF
HKL
Paper
C14 H14 Cu N2 O4P c a 219.6232; 10.8138; 27.219
90; 90; 90
2832.5Li, Yu-Guang; Zhu, Hai-Liang; Chen, Xin-Zhi; Ng, Seik Weng
Aqua(pyridine-κ<i>N</i>)(<i>N</i>-salicylideneglycinato-κ^3^<i>N</i>,<i>O</i>,<i>O</i>')copper(II)
Acta Crystallographica Section E, 2005, 61, m2385-m2387

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