Crystallography Open Database

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2241400 CIF
HKL
Paper
C22 H20 N4 O3 SP 1 21/n 19.9767; 8.7342; 23.1027
90; 94.508; 90
2006.9Ellouz, M.; Sebbar, N. K.; Essassi, E. M.; Ouzidan, Y.; Mague, J. T.
Crystal structure of (<i>Z</i>)-ethyl 2-{5-[(2-benzylidene-3-oxo-2,3-dihydrobenzo[<i>b</i>][1,4]thiazin-4-yl)methyl]-1<i>H</i>-1,2,3-triazol-1-yl}acetate
Acta Crystallographica Section E, 2015, 71, o1022-o1023
2241401 CIF
HKL
C16 H24 O3P 1 21 16.4443; 8.4437; 13.7083
90; 98.654; 90
737.43Bismoussa, Abdoullah; Ait Itto, My Youssef; Daran, Jean-Claude; Auhmani, Abdelwahed; Auhmani, Aziz
Crystal structure of (1<i>R</i>,3<i>S</i>,8<i>R</i>,11<i>R</i>)-11-acetyl-3,7,7-trimethyl-10-oxatricyclo[6.4.0.0^1,3^]dodecan-9-one
Acta Crystallographica Section E, 2015, 71, o1013-o1014
2241402 CIF
HKL
C24 H42 N4 Si2 ZnF d d 229.7954; 21.3566; 8.5844
90; 90; 90
5462.5Chen, Juan
Crystal structure of bis{<i>N</i>-[(diethylamino)dimethylsilyl]anilido-κ^2^<i>N</i>,<i>N</i>'}zinc
Acta Crystallographica Section E, 2015, 71, m246
2241403 CIF
HKL
Paper
C23 H23 N O6 SP 1 21/n 18.3458; 24.657; 10.9448
90; 91.121; 90
2251.8Umadevi, M.; Raju, Potharaju; Yamuna, R.; Mohanakrishnan, Arasambattu K.; Chakkaravarthi, G.
Crystal structure of (<i>E</i>)-diethyl 2-[(1-phenylsulfonyl-1<i>H</i>-indol-3-yl)methylidene]succinate
Acta Crystallographica Section E, 2015, 71, o1029-o1030
2241404 CIF
HKL
Paper
C21 H16 N2 O2P -16.3833; 10.6009; 13.0915
108.823; 95.906; 97.467
821.44Mague, Joel T.; Mohamed, Shaaban K.; Akkurt, Mehmet; Younes, Sabry H. H.; Albayati, Mustafa R.
Crystal structure of 2-amino-4-(4-methoxyphenyl)-4<i>H</i>-benzo[<i>g</i>]chromene-3-carbonitrile
Acta Crystallographica Section E, 2015, 71, o1017-o1018
2241405 CIF
HKL
Paper
C16 H17 Cl N2 O3P -111.5494; 12.474; 13.043
102.369; 105.501; 109.001
1615.8Efimov, Ilya; Slepukhin, Pavel; Bakulev, Vasiliy
Crystal structure of ethyl 3-(4-chlorophenyl)-5-[(<i>E</i>)-2-(dimethylamino)ethenyl]-1,2-oxazole-4-carboxylate
Acta Crystallographica Section E, 2015, 71, o1028
2241406 CIF
HKL
Paper
C19 H14 N2 O2 SP -16.0469; 10.8135; 13.326
109.943; 93.226; 95.439
811.76Bakhouch, Mohamed; El Yazidi, Mohamed; Kerbal, Abdelali; Saadi, Mohamed; El Ammari, Lahcen
Crystal structure of 2-amino-3-cyano-4-(4-methoxyphenyl)-4<i>H</i>-1-benzothieno[3,2-<i>b</i>]pyran
Acta Crystallographica Section E, 2015, 71, o1043-o1044
2241407 CIF
HKL
Paper
C63 H76 B2 N6C 1 c 117.1964; 17.6641; 17.4751
90; 98.752; 90
5246.4Tiritiris, Ioannis; Kantlehner, Willi
Crystal structure of <i>N</i>-[3-(dimethylamino)propyl]-<i>N</i>',<i>N</i>',<i>N</i>'',<i>N</i>''-tetramethyl-<i>N</i>-(<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylformamidiniumyl)guanidinium bis(tetraphenylborate)
Acta Crystallographica Section E, 2015, 71, o1045-o1046
2241408 CIF
HKL
Paper
C16 H14 Cl2 Hg N4 SP b c a13.8558; 15.4983; 16.1108
90; 90; 90
3459.65Bouchouit, Mehdi; Benzerka, Saida; Bouraiou, Abdelmalek; Merazig, Hocine; Belfaitah, Ali; Bouacida, Sofiane
Crystal structure of {bis[(1<i>H</i>-benzimidazol-2-yl-κ<i>N</i>^3^)methyl]sulfane}dichloridomercury(II)
Acta Crystallographica Section E, 2015, 71, m253-m254
2241409 CIF
HKL
Paper
C21 H19 Cl3 Hg N2C 1 2/c 120.3669; 14.8837; 7.2154
90; 104.372; 90
2118.79Bouchouit, Mehdi; Bouraiou, Abdelmalek; Bouacida, Sofiane; Merazig, Hocine; Belfaitah, Ali; Bahnous, Mebarek
Crystal structure of <i>catena</i>-poly[1,3-dibenzylbenzimidazolium [[chloridomercurate(II)]-di-μ-chlorido]]
Acta Crystallographica Section E, 2015, 71, m255-m256
2241410 CIF
HKL
Paper
C30 H23 N3 O4P 1 21/n 110.9058; 9.5178; 23.8651
90; 95.378; 90
2466.27Mathusalini, Sadasivam; Viswanathan, Vijayan; Mohan, Palathurai Subramaniam; Lin, Chia-Her; Velmurugan, Devadasan
Crystal structure of 4'-(2-methoxyquinolin-3-yl)-1'-methyldispiro[indan-2,2'-pyrrolidine-3',3''-indoline]-1,3,2''-trione
Acta Crystallographica Section E, 2015, 71, o1038-o1039
2241411 CIF
HKL
Paper
C18 H20 I N3P 1 21/n 17.6704; 9.9341; 22.8541
90; 98.982; 90
1720.09Canseco-González, Daniel; García, Juventino J.; Flores-Alamo, Marcos
Crystal structure of 1-mesityl-3-methyl-4-phenyl-1<i>H</i>-1,2,3-triazol-3-ium iodide
Acta Crystallographica Section E, 2015, 71, o1041-o1042
2241412 CIF
HKL
Paper
C13 H12 N2P 1 21/c 19.8029; 10.4175; 11.4984
90; 115.138; 90
1063Harrypersad, Shane; Foucher, Daniel; Lough, Alan J.
Crystal structure of (<i>E</i>)-(benzylidene)(pyridin-2-ylmethyl)amine
Acta Crystallographica Section E, 2015, 71, o1040
2241413 CIF
HKL
Paper
C21 H16 N2 O3P 1 21/c 18.9028; 11.4507; 17.0274
90; 104.618; 90
1679.64Lamera, Esma; Benzerka, Saida; Bouraiou, Abdelmalek; Bouacida, Sofiane; Merazig, Hocine; Chibani, Aissa; Le Borgne, Marc; Bouaziz, Zouhair
Crystal structure of 13-phenyl-2,3,4,13-tetrahydro-1<i>H</i>-indazolo[1,2-<i>b</i>]phthalazine-1,6,11-trione
Acta Crystallographica Section E, 2015, 71, o1036-o1037
2241414 CIF
HKL
C18 H18 Cl N3 SP 1 21/c 110.58; 12.0438; 13.9561
90; 90.196; 90
1778.3Tan, Ming Yueh; Crouse, Karen A.; Ravoof, Thahira Begum S. A.; Tiekink, Edward R. T.
Crystal structure of 1-{(<i>Z</i>)-[(2<i>E</i>)-3-(4-chlorophenyl)-1-phenylprop-2-en-1-ylidene]amino}-3-ethylthiourea
Acta Crystallographica Section E, 2015, 71, o1047-o1048
2241415 CIF
HKL
Paper
C22 H36 In Li N2 O2P 1 21/c 19.0991; 16.4481; 16.4256
90; 91.956; 90
2456.9Briand, Glen G.; Decken, Andreas; Hoey, Marshall R.
Crystal structure of dimethyl-1κ^2^<i>C</i>-bis(μ-4-methylphenolato-1:2κ^2^<i>O</i>:<i>O</i>)(<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylethylenediamine-2κ^2^<i>N</i>,<i>N</i>')indium(III)lithium(I)
Acta Crystallographica Section E, 2015, 71, m257-m258
2241416 CIF
HKL
Paper
C28 H30 Br N3 O5P 1 21/n 111.656; 17.997; 13.463
90; 97.351; 90
2801Moriguchi, Tetsuji; Jalli, Venkataprasad; Krishnamurthy, Suvratha; Tsuge, Akihiko; Yoza, Kenji
Crystal structure of ethyl 2-(2-{1-[<i>N</i>-(4-bromophenyl)-2-oxo-2-phenylacetamido]-2-<i>tert</i>-butylamino-2-oxoethyl}-1<i>H</i>-pyrrol-1-yl)acetate
Acta Crystallographica Section E, 2015, 71, o1049-o1050
2241417 CIF
HKL
C9 H7 Au Cl4 I NP -17.6299; 7.8609; 11.7125
80.16; 78.143; 85.178
676.52Onserio, Benard O.; Tamang, Sem Raj; Hoefelmeyer, James D.
Crystal structure of 8-iodoquinolinium tetrachloridoaurate(III)
Acta Crystallographica Section E, 2015, 71, m261-m262
2241418 CIF
HKL
Paper
C12 H26 Cd2 Cl6 N4P b c a12.317; 12.289; 14.44
90; 90; 90
2185.7Yan, Jing-Jing; Pan, Qi-Jian; Chen, Li-Zhuang
Crystal structure of di-μ~2~-chlorido-bis[(1-aza-4-azoniabicyclo[2.2.2]octane-κ<i>N</i>^1^)dichloridodicadmium]
Acta Crystallographica Section E, 2015, 71, m259-m260
2241480 CIF
Paper
C15 H33 Br2 N3 O SiP b c a13.3524; 11.3802; 27.4261
90; 90; 90
4167.5Tiritiris, Ioannis; Kress, Ralf; Kantlehner, Willi
Crystal structure of 2-bromo-3-dimethylamino-<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>',4-pentamethyl-4-(trimethylsilyloxy)pent-2-eneamidinium bromide
Acta Crystallographica Section E, 2015, 71, o1061-o1062
2241481 CIF
HKL
C18 H18 N2 O2C 1 c 112.0839; 6.4197; 19.7427
90; 104.826; 90
1480.5Adam, Farook; Samshuddin, Seranthimata; Shruthi; Narayana, Badiadka; Ameram, Nadiah
Crystal structure of 5-(4-methoxyphenyl)-3-(4-methylphenyl)-4,5-dihydro-1<i>H</i>-pyrazole-1-carbaldehyde
Acta Crystallographica Section E, 2015, 71, o1093-o1094
2241482 CIF
HKL
Paper
C5 H4 Cl2 N2P 1 21/n 17.463; 7.827; 11.79
90; 93.233; 90
687.6Medjani, Meriem; Hamdouni, Noudjoud; Brihi, Ouarda; Boudjada, Ali; Meinnel, Jean
Crystal structure of 4,6-dichloro-5-methylpyrimidine
Acta Crystallographica Section E, 2015, 71, o1073-o1074
2241483 CIF
HKL
Paper
C12 H32 Br2 Ni O4P 1 21/c 15.8341; 10.4902; 16.613
90; 97.074; 90
1009Lv, Yaokang; Liu, Mingxian; Ji, Lvlv; Zhang, Cheng; Ouyang, Mi
Crystal structure of dibromidotetrakis(propan-2-ol-κ<i>O</i>)nickel(II)
Acta Crystallographica Section E, 2015, 71, m263-m264
2241484 CIF
HKL
Paper
C18 H16 Cl5 Fe N2P -18.424; 10.435; 13.022
109.626; 100.197; 90.893
1057.7Boudjarda, Azzedine; Bouchouit, Karim; Arroudj, Samiha; Bouacida, Sofiane; Merazig, Hocine
Crystal structure of bis(quinolin-1-ium) tetrachloridoferrate(III) chloride
Acta Crystallographica Section E, 2015, 71, m273-m274
2241485 CIF
HKL
C5 H11 N5 OP -18.2472; 9.731; 10.087
90.3; 96.228; 96.259
799.8Park, Hyun Sik; Ryu, Ji Yeon; Lee, Junseong
Crystal structure of 1-(5-amino-2<i>H</i>-tetrazol-2-yl)-2-methylpropan-2-ol
Acta Crystallographica Section E, 2015, 71, o1057-o1058
2241486 CIF
HKL
C14 H20 F N O3 SP 21 21 219.1809; 9.2384; 18.577
90; 90; 90
1575.6Zhao, Zhiwei; Fan, Wenqiang; Zhang, Yixiang; Li, Ya
Crystal structure of methyl (2<i>R</i>,3<i>S</i>)-3-[(<i>tert</i>-butylsulfinyl)amino]-2-fluoro-3-phenylpropanoate
Acta Crystallographica Section E, 2015, 71, o1055-o1056
2241487 CIF
HKL
Paper
C23 H16 O2 SP n a 2112.02; 7.576; 18.521
90; 90; 90
1687Valderrama-García, Bianca X.; Reyes-Martínez, Reyna; Hernández-Ortega, Simón; Morales-Morales, David; Rivera, Ernesto
Crystal structure of 2-(thiophen-3-yl)ethyl pyrene-1-carboxylate
Acta Crystallographica Section E, 2015, 71, o926-o927
2241488 CIF
HKL
Paper
C16 H42 N8 O5C 1 c 18.3245; 22.536; 13.258
90; 108.092; 90
2364.2Tiritiris, Ioannis; Kantlehner, Willi
Crystal structure of <i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>',<i>N</i>'',<i>N</i>''-hexamethylguanidinium cyanate 1.5-hydrate
Acta Crystallographica Section E, 2015, 71, o1076-o1077
2241489 CIF
HKL
C46 H52 N4 O16 Zn4P -110.4894; 10.7917; 11.955
103.425; 94.323; 115.677
1162.17Cai, Xue; Ning, Hui
Crystal structure of di-μ-acetato-diacetatobis(μ-6,6'-dimethoxy-2,2'-{[(propane-1,3-diylbis(azanylylidene)]bis(methanylylidene)}diphenolato)tetrazinc
Acta Crystallographica Section E, 2015, 71, m217-m218
2241490 CIF
HKL
C26 H25 N O6 SP -18.3501; 8.4859; 17.6814
84.424; 80.952; 80.954
1218.52Trigunait, Ankur; Damodharan, Kannan; Manickam, Bakthadoss; Krishnasamy, Gunasekaran
Crystal structure of methyl (2<i>Z</i>)-2-{[<i>N</i>-(2-formylphenyl)-4-methylbenzenesulfonamido]methyl}-3-(4-methoxyphenyl)prop-2-enoate
Acta Crystallographica Section E, 2015, 71, o1088-o1089
2241491 CIF
HKL
C20 H20 N2 OP c c n19.872; 20.304; 8.2924
90; 90; 90
3345.8Adam, Farook; Smitha, Kanathur; Charishma, Sharath Poojary; Samshuddin, Seranthimata; Ameram, Nadiah
Crystal structure of 1-{3-(4-methylphenyl)-5-[(<i>E</i>)-2-phenylethenyl]-4,5-dihydro-1<i>H</i>-pyrazol-1-yl}ethan-1-one
Acta Crystallographica Section E, 2015, 71, o1095-o1096
2241492 CIF
HKL
C30 H20 O2 S2P 1 21/n 113.7674; 8.9849; 19.7586
90; 104.022; 90
2371.29Förster, Sebastian; Seichter, Wilhelm; Weber, Edwin
Crystal structure of 1,3-bis{[4-(acetylsulfanyl)phenyl]ethynyl}azulene
Acta Crystallographica Section E, 2015, 71, o1099-o1100
2241493 CIF
HKL
C4 H8 Br4 S2 SnP 1 21/n 17.1033; 12.0526; 7.4032
90; 112.144; 90
587.06Reuter, Hans; Röwekamp-Krugley, Natalia; Imwalle, Marius; Keil, Simona; Reichelt, Martin
Crystal structure of a one-dimensional coordination polymer of tin(IV) bromide with 1,4-dithiane
Acta Crystallographica Section E, 2015, 71, m267-m268
2241494 CIF
HKL
C30 H40 O6 SP 1 21 19.909; 10.2373; 13.8402
90; 101; 90
1378.2Gul, Waseem; Galal, Ahmed; ElSohly, Mahmoud A.; Carvalho, Paulo
Crystal structure of (9<i>S</i>,10<i>S</i>)-10-ethoxy-9-hydroxy-6,6,9-trimethyl-3-pentyl-7,8,9,10-tetrahydro-6<i>H</i>-benzo[<i>c</i>]chromen-1-yl 4-methylbenzenesulfonate
Acta Crystallographica Section E, 2015, 71, o1082-o1083
2241495 CIF
HKL
Paper
C15 H40 Br1.99 N6 O2P 1 21 19.1584; 12.2932; 10.6633
90; 97.454; 90
1190.39Tiritiris, Ioannis; Kantlehner, Willi
Crystal structure of <i>N</i>-[3-(dimethylazaniumyl)propyl]-<i>N</i>',<i>N</i>',<i>N</i>'',<i>N</i>''-tetramethyl-<i>N</i>-(<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylformamidiniumyl)guanidinium dibromide hydroxide monohydrate
Acta Crystallographica Section E, 2015, 71, o1078-o1079
2241496 CIF
HKL
Paper
C32 H28 N4 O2 SP -16.2343; 14.6968; 15.054
90.234; 92.612; 99.497
1358.9Wang, Hewen
Crystal structure of (<i>E</i>)-3-[4-(benzylideneamino)-5-sulfanylidene-3-(<i>p</i>-tolyl)-4,5-dihydro-1<i>H</i>-1,2,4-triazol-1-yl]-3-(4-methoxyphenyl)-1-phenylpropan-1-one
Acta Crystallographica Section E, 2015, 71, o1080-o1081
2241497 CIF
HKL
Paper
C50 H46 N2 Ni O4P -112.4401; 16.8987; 21.5185
100.843; 100.029; 99.89
4276.1Gupta, Abhishek K.; Butcher, Ray J.; Sil, Anjan
Crystal structure of {6,6'-dibenzoyl-4,4'-di-<i>tert</i>-butyl-2,2'-[(ethane-1,2-diyl)dinitrilobis(phenylmethanylylidene)]diphenolato-κ^4^<i>O</i>^1^,<i>N</i>,<i>N</i>',<i>O</i>^1'^}nickel(II)
Acta Crystallographica Section E, 2015, 71, 1485-1487
2241498 CIF
HKL
Paper
C68 H50 Cl2 Mn2 N8 O14P 1 21/n 113.348; 17.136; 14.499
90; 111.321; 90
3089.4Kani, Ibrahim
Crystal structure of bis(μ-2-benzoylbenzoato-κ^2^<i>O</i>:<i>O</i>')bis[bis(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')manganese(II)] bis(perchlorate)
Acta Crystallographica Section E, 2015, 71, m265-m266
2241499 CIF
HKL
Paper
C28 H22 O P2P 1 21/c 110.7179; 8.5559; 24.55
90; 94.309; 90
2244.9Martínez de León, Carla; Tlahuext, Hugo; Grévy, Jean-Michel
Crystal structure of 2,5-bis(diphenylphosphanyl)furan
Acta Crystallographica Section E, 2015, 71, o922-o923
2241500 CIF
HKL
Paper
C55.5 H78 Cl4 N2 O4 Si2P -113.9017; 13.9542; 16.9827
69.649; 65.978; 83.585
2819.6Kuchuk, Ekaterina A.; Zaitsev, Kirill V.; Karlov, Sergey S.; Egorov, Mikhail P.; Churakov, Andrei V.
Crystal structure of 4,8-di-<i>tert</i>-butyl-6,6-dichloro-13-ethyl-2,10-dimethyl-13,14-dihydro-12<i>H</i>-dibenzo[<i>d</i>,<i>i</i>][1,3,7,2]dioxazasilecine toluene 0.25-solvate
Acta Crystallographica Section E, 2015, 71, o1065-o1066
2241501 CIF
HKL
C14 H17 I N4P 1 21/c 118.0508; 7.279; 11.376
90; 98.929; 90
1476.6Chulvi, Katherine; Costero, Ana; Ochando, Luis E.; Gaviña, Pablo
Crystal structure of 4-{2-[4-(dimethylamino)phenyl]diazen-1-yl}-1-methylpyridinium iodide
Acta Crystallographica Section E, 2015, 71, o1069-o1070
2241502 CIF
HKL
Paper
C10 H7 F3 O2P 1 21/c 111.4093; 5.7749; 14.7469
90; 96.3; 90
965.77Barkov, Alexey
Crystal structure of (<i>E</i>)-4,4,4-trifluoro-3-phenylbut-2-enoic acid
Acta Crystallographica Section E, 2015, 71, o1090
2241503 CIF
HKL
Paper
C16 H24 N4 O6 S2P b c a10.1709; 8.4461; 21.5569
90; 90; 90
1851.83Kumar, K. Sathesh; Ranjith, S.; Sudhakar, S.; Srinivasan, P.; Ponnuswamy, M. N.
Crystal structure of piperazine-1,4-diium bis(4-aminobenzenesulfonate)
Acta Crystallographica Section E, 2015, 71, o1084-o1085
2241504 CIF
HKL
C11 H10 O4P 1 21/c 15.8096; 13.2034; 12.5738
90; 97.641; 90
955.93Gowda, Ramakrishna; Gowda, K. V. Arjuna; Reddy, M. Keshava; Basanagouda, Mahantesha
Crystal structure of 2-(5-methoxy-1-benzofuran-3-yl)acetic acid
Acta Crystallographica Section E, 2015, 71, o1053-o1054
2241505 CIF
HKL
Paper
C9 H9 N OP b c a10.231; 7.584; 41.816
90; 90; 90
3245Bugenhagen, Bernhard; Al Soom, Nuha; Al Jasem, Yosef; Thiemann, Thies
Crystal structure of (1<i>Z</i>,2<i>E</i>)-cinnamaldehyde oxime
Acta Crystallographica Section E, 2015, 71, o1063-o1064
2241506 CIF
HKL
Paper
C72 H78 B2 N4P 1 21/c 120.3677; 12.1101; 25.558
90; 112.507; 90
5823.8Tiritiris, Ioannis; Kantlehner, Willi
Crystal structure of <i>N</i>''-benzyl-<i>N</i>''-[3-(benzyldimethylazaniumyl)propyl]-<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylguanidinium bis(tetraphenylborate)
Acta Crystallographica Section E, 2015, 71, o1086-o1087
2241507 CIF
HKL
Paper
C10 H15 N OP b c a14.5166; 15.9102; 16.0527
90; 90; 90
3707.6Golen, James A.; McDonald, Kyle J.; Manke, David R.
Crystal structure of 3-(diethylamino)phenol
Acta Crystallographica Section E, 2015, 71, o1075
2241508 CIF
HKL
Paper
C22 H51 Co2 N9 O15R 3 28.543; 8.543; 39.11
90; 90; 120
2472Sethi, Waqas; Johannesen, Heini V.; Morsing, Thorbjørn J.; Piligkos, Stergios; Weihe, Høgni
Crystal structure of trihydrogen bis{[1,1,1-tris(2-oxidoethylaminomethyl)ethane]cobalt(III)} trinitrate
Acta Crystallographica Section E, 2015, 71, m275-m276
2241509 CIF
HKL
Paper
C34 H25 Cl N2 O2P 1 21/c 111.1328; 13.0756; 19.0866
90; 103.738; 90
2698.91Joseph, J. M.; Viswanathan, Vijayan; Velmurugan, Devadasan
Crystal structure of 15-(2-chlorophenyl)-6b-hydroxy-17-methyl-6b,7,16,17-tetrahydro-7,14a-methanonaphtho[1',8':1,2,3]pyrrolo[3',2':8,8<i>a</i>]azuleno[5,6-<i>b</i>]quinolin-14(15<i>H</i>)-one
Acta Crystallographica Section E, 2015, 71, o1091-o1092
2241510 CIF
HKL
Paper
C12 H10 Cl2 N2 O2P 1 21/n 17.6789; 13.2199; 12.4129
90; 102.561; 90
1229.93Lahmidi, Sanae; Essaghouani, Abdelhanine; Essassi, El Mokhtar; Saadi, Mohamed; El Ammari, Lahcen
Crystal structure of (<i>Z</i>)-7,8-dichloro-4-(2-oxopropylidene)-4,5-dihydro-1<i>H</i>-1,5-benzodiazepin-2(3<i>H</i>)-one
Acta Crystallographica Section E, 2015, 71, o1059-o1060
2241511 CIF
HKL
C17 H19 N3 S2P 1 c 19.0073; 12.3856; 7.5553
90; 98.62; 90
833.35Ravoof, Thahira Begum S. A.; Tiekink, Edward R. T.; Omar, Siti Aminah; Begum, Sharifa Zaithun; Tahir, Mohamed I. M.
Crystal structure of (<i>Z</i>)-4-methylbenzyl 3-[1-(5-methylpyridin-2-yl)ethylidene]dithiocarbazate
Acta Crystallographica Section E, 2015, 71, o1071-o1072
2241512 CIF
HKL
C81 H69 B4 F16 N15 Zn2C 1 2/c 154.177; 13.6929; 21.9343
90; 95.713; 90
16190.9Alexandru, Maria-Gabriela; Dumitru, Florina
Crystal structure of tris(μ-bis{4-[(pyridin-2-ylmethylidene)amino]phenyl}methane-κ^4^<i>N</i>,<i>N</i>':<i>N</i>'',<i>N</i>''')dizinc tetrakis(tetrafluoridoborate) acetonitrile trisolvate
Acta Crystallographica Section E, 2015, 71, m271-m272
2241513 CIF
HKL
C86 H116 F6 Fe K N4 O32 S2P -112.1294; 14.1636; 15.5934
84.081; 72.567; 64.895
2313.5Ben Haj Hassen, Leila; Denden, Zouhour; Rousselin, Yoann; Nasri, Habib
Crystal structure of diaqua[5,10,15,20-tetrakis(4-methoxyphenyl)porphyrinato-κ^4^<i>N</i>]iron(III) diaqua(18-crown-6)potassium bis(trifluoromethanesulfonate)‒18-crown-6 (1/2)
Acta Crystallographica Section E, 2015, 71, m215-m216
2241514 CIF
HKL
C14 H12 Br NP b c a15.263; 7.745; 20.41
90; 90; 90
2413Bezuglyi, Mykola; Grybauskaite, Gintare; Bagdziunas, Gintautas; Grazulevicius, Juozas Vidas
Crystal structure of 3-bromo-9-ethyl-9<i>H</i>-carbazole
Acta Crystallographica Section E, 2015, 71, o1067-o1068
2241515 CIF
HKL
Paper
C18 H18 N2 O4 S2P 21 21 216.8841; 12.2326; 20.1911
90; 90; 90
1700.3Pereira, Patrícia A.; Noll, Bruce C.; Oliver, Allen G.; Silveira, Gustavo P.
Crystal structure of 4-methyl-<i>N</i>-{(<i>E</i>)-methyl[(3a<i>R</i>,8a<i>S</i>)-2-oxo-3,3a,8,8a-tetrahydro-2<i>H</i>-indeno[1,2-<i>d</i>][1,3]oxazol-3-yl]-λ^4^-sulfanylidene}benzenesulfonamide
Acta Crystallographica Section E, 2015, 71, o1097-o1098
2241516 CIF
HKL
Paper
C6 H6 N6 SP -16.3001; 7.393; 18.159
91.407; 95.864; 102.695
819.8Thomann, Andreas; Huch, Volker; Hartmann, Rolf W.
Crystal structure of 4-methylsulfanyl-2-(2<i>H</i>-tetrazol-2-yl)pyrimidine
Acta Crystallographica Section E, 2015, 71, o1051-o1052
2300485 CIF
HKL
Paper
Pt7 Sc4 Si2P b a m6.462; 16.147; 3.988
90; 90; 90
416.1Krause, Lennard; Herbst-Irmer, Regine; Sheldrick, George M.; Stalke, Dietmar
Comparison of silver and molybdenum microfocus X-ray sources for single-crystal structure determination
Journal of Applied Crystallography, 2015, 48
2300486 CIF
HKL
Paper
Pt7 Sc4 Si2P b a m6.447; 16.121; 3.982
90; 90; 90
413.9Krause, Lennard; Herbst-Irmer, Regine; Sheldrick, George M.; Stalke, Dietmar
Comparison of silver and molybdenum microfocus X-ray sources for single-crystal structure determination
Journal of Applied Crystallography, 2015, 48
2300487 CIF
HKL
Paper
Br0.09 Cl0.91 Cu6 O8 PbF m -3 m9.216; 9.216; 9.216
90; 90; 90
782.8Krause, Lennard; Herbst-Irmer, Regine; Sheldrick, George M.; Stalke, Dietmar
Comparison of silver and molybdenum microfocus X-ray sources for single-crystal structure determination
Journal of Applied Crystallography, 2015, 48
2300488 CIF
Paper
Br0.1 Cl0.9 Cu6 O8 PbF m -3 m9.2164; 9.2164; 9.2164
90; 90; 90
782.86Krause, Lennard; Herbst-Irmer, Regine; Sheldrick, George M.; Stalke, Dietmar
Comparison of silver and molybdenum microfocus X-ray sources for single-crystal structure determination
Journal of Applied Crystallography, 2015, 48
2300489 CIF
HKL
Paper
H4 Na2 O6 WP b c a8.439; 10.559; 13.807
90; 90; 90
1230.3Krause, Lennard; Herbst-Irmer, Regine; Sheldrick, George M.; Stalke, Dietmar
Comparison of silver and molybdenum microfocus X-ray sources for single-crystal structure determination
Journal of Applied Crystallography, 2015, 48
2300490 CIF
HKL
Paper
H4 Na2 O6 WP b c a8.442; 10.569; 13.816
90; 90; 90
1232.7Krause, Lennard; Herbst-Irmer, Regine; Sheldrick, George M.; Stalke, Dietmar
Comparison of silver and molybdenum microfocus X-ray sources for single-crystal structure determination
Journal of Applied Crystallography, 2015, 48
2300491 CIF
HKL
Paper
C4 Co Sc3I m m m3.394; 4.374; 11.995
90; 90; 90
178.07Krause, Lennard; Herbst-Irmer, Regine; Sheldrick, George M.; Stalke, Dietmar
Comparison of silver and molybdenum microfocus X-ray sources for single-crystal structure determination
Journal of Applied Crystallography, 2015, 48
2300492 CIF
HKL
Paper
C4 Co Sc3I m m m3.398; 4.377; 12.003
90; 90; 90
178.52Krause, Lennard; Herbst-Irmer, Regine; Sheldrick, George M.; Stalke, Dietmar
Comparison of silver and molybdenum microfocus X-ray sources for single-crystal structure determination
Journal of Applied Crystallography, 2015, 48
2300493 CIF
HKL
Paper
C16 H13 Br2 NP 1 21/n 19.601; 8.377; 17.201
90; 97.35; 90
1372.1Krause, Lennard; Herbst-Irmer, Regine; Sheldrick, George M.; Stalke, Dietmar
Comparison of silver and molybdenum microfocus X-ray sources for single-crystal structure determination
Journal of Applied Crystallography, 2015, 48
2300494 CIF
Paper
C16 H13 Br2 NP 1 21/n 19.599; 8.378; 17.194
90; 97.32; 90
1371.5Krause, Lennard; Herbst-Irmer, Regine; Sheldrick, George M.; Stalke, Dietmar
Comparison of silver and molybdenum microfocus X-ray sources for single-crystal structure determination
Journal of Applied Crystallography, 2015, 48
2300495 CIF
HKL
Paper
C30 H46 Br2 Cl2 Co N4 Si2P 1 21/n 118.568; 9.504; 21.378
90; 102.95; 90
3676.6Krause, Lennard; Herbst-Irmer, Regine; Sheldrick, George M.; Stalke, Dietmar
Comparison of silver and molybdenum microfocus X-ray sources for single-crystal structure determination
Journal of Applied Crystallography, 2015, 48
2300496 CIF
HKL
Paper
C30 H46 Br2 Cl2 Co N4 Si2P 1 21/n 118.588; 9.518; 21.403
90; 102.95; 90
3690.3Krause, Lennard; Herbst-Irmer, Regine; Sheldrick, George M.; Stalke, Dietmar
Comparison of silver and molybdenum microfocus X-ray sources for single-crystal structure determination
Journal of Applied Crystallography, 2015, 48
2300497 CIF
HKL
Bi1.09 Ge2.37 Te4F m -3 m6.055; 6.055; 6.055
90; 90; 90
221.99Urban, Philipp; Simonov, Arkadiy; Weber, Thomas; Oeckler, Oliver
Real structure of Ge4Bi2Te7: refinement on diffuse scattering data with the 3D-ΔPDF method
Journal of Applied Crystallography, 2015, 48, 200
2300498 CIF
Paper
K0.5 Na0.5 Nb O3R 3 m :H5.6085; 5.6085; 6.9183
90; 90; 120
188.46Orayech, B.; Faik, A.; López, G. A.; Fabelo, O.; Igartua, J. M.
Mode-crystallography analysis of the crystal structures and the low- and high-temperature phase transitions in Na~0.5~K~0.5~NbO~3~
Journal of Applied Crystallography, 2015, 48
2300499 CIF
Paper
K0.5 Na0.5 Nb O3A m m 23.9443; 5.6425; 5.6763
90; 90; 90
126.33Orayech, B.; Faik, A.; López, G. A.; Fabelo, O.; Igartua, J. M.
Mode-crystallography analysis of the crystal structures and the low- and high-temperature phase transitions in Na~0.5~K~0.5~NbO~3~
Journal of Applied Crystallography, 2015, 48
2300501 CIF
HKL
C7 H10 N2 O2C 1 2/c 117.822; 4.85; 19.783
90; 102.37; 90
1670.3Graiff, Claudia; Pontiroli, Daniele; Bergamonti, Laura; Cavallari, Chiara; Lottici, Pier Paolo; Predieri, Giovanni
Structural investigation of <i>N</i>,<i>N</i>'-methylenebisacrylamide <i>via</i> X-ray diffraction assisted by crystal structure prediction
Journal of Applied Crystallography, 2015, 48, 550-557
2300502 CIFC13 H15 Co N2 O7P 1 21/c 112.6105; 7.6858; 15.9256
90; 106.541; 90
1479.66Cox, Jordan M.; Walton, Ian M.; Benson, Cassidy A.; Chen, Yu-Sheng; Benedict, Jason B.
A versatile environmental control cell for <i>in situ</i> guest exchange single-crystal diffraction
Journal of Applied Crystallography, 2015, 48, 578-581
2300503 CIF
HKL
C42 H80 Br2 N2 O3C 1 2/c 154.695; 9.8891; 16.877
90; 92.628; 90
9118.9Chen, Qibin; Yao, Junyao; Hu, Xin; Shen, Jincheng; Sheng, Yujie; Liu, Honglai
Monolayer effect of a gemini surfactant with a rigid biphenyl spacer on its self-crystallization at the air/liquid interface
Journal of Applied Crystallography, 2015, 48
2300504 CIF
HKL
Mg Mo O4C 1 2/m 110.157; 9.246; 7.03
90; 105.9; 90
634.94Gemmi, Mauro; La Placa, Maria G. I.; Galanis, Athanassios S.; Rauch, Edgar F.; Nicolopoulos, Stavros
Fast electron diffraction tomography
Journal of Applied Crystallography, 2015, 48
2300505 CIF
HKL
C28 H26 N2 O4P 1 21/n 15.9038; 10.7455; 19.4895
90; 90.263; 90
1236.39Kong, Jianfei; Du, Jialei; Wang, Jiren; Chen, Zuofeng
Supramolecular organic frameworks of a Schiff base showing selective guest adsorption
Journal of Applied Crystallography, 2015, 48
2300506 CIF
HKL
C24 H22 Cl6 N2 O4P 1 21/n 16.8524; 11.9655; 17.3274
90; 99.678; 90
1400.5Kong, Jianfei; Du, Jialei; Wang, Jiren; Chen, Zuofeng
Supramolecular organic frameworks of a Schiff base showing selective guest adsorption
Journal of Applied Crystallography, 2015, 48
2300507 CIF
HKL
C26 H28 N2 O5P 1 21/c 113.2363; 11.765; 17.6353
90; 103.281; 90
2672.8Kong, Jianfei; Du, Jialei; Wang, Jiren; Chen, Zuofeng
Supramolecular organic frameworks of a Schiff base showing selective guest adsorption
Journal of Applied Crystallography, 2015, 48
2300508 CIF
HKL
C32 H28 N4 O4P 1 2/c 112.8209; 7.0395; 14.7623
90; 96.82; 90
1322.91Kong, Jianfei; Du, Jialei; Wang, Jiren; Chen, Zuofeng
Supramolecular organic frameworks of a Schiff base showing selective guest adsorption
Journal of Applied Crystallography, 2015, 48
2300509 CIF
HKL
C6 H9 N3 O6P n a 219.0136; 21.5; 4.7005
90; 90; 90
910.9Prasad, A. Aditya; Meenakshisundaram, S. P.
Hydrogen-bonded supramolecular architecture in nonlinear optical ammonium 2,4-dinitrophenolate hydrate
Journal of Applied Crystallography, 2015, 48
2300513 CIF
HKL
C32 H39 N O2P 1 21/c 116.589; 10.9575; 16.6795
90; 113.623; 90
2777.8Sharma, Ranjana; Prasher, Dixit; Tiwari, R. K.
Crystal structure analysis of ebastine [4-(4-benzhydryloxy-1-piperidyl)-1-(4-<i>tert</i>-butylphenyl) butan-1-one]: an oral histamine antagonist
Journal of Applied Crystallography, 2015, 48
2300556 CIFCl H Ni OR -3 m :H3.26061; 3.26061; 17.00619
90; 90; 120
156.58Bette, Sebastian; Dinnebier, Robert E.; Freyer, Daniela
Structure solution and refinement of stacking-faulted NiCl(OH)
Journal of Applied Crystallography, 2015, 48
2300557 CIF
HKL
C12 H22 O11P 1 21 17.763; 8.7109; 10.8701
90; 102.937; 90
716.407Dmitrienko, Artem O.; Bushmarinov, Ivan S.
Reliable structural data from Rietveld refinements <i>via</i> restraint consistency
Journal of Applied Crystallography, 2015, 48
2300558 CIFNi SiP n m a5.1731; 3.3381; 5.6049
90; 90; 90
96.79Lord, Oliver T.; Thomson, Andrew R.; Wann, Elizabeth T. H.; Wood, Ian G.; Dobson, David P.; Vocadlo, Lidunka
The equation of state of the <i>Pmmn</i> phase of NiSi
Journal of Applied Crystallography, 2015, 48, 1914-1920
2300559 CIF
HKL
Paper
C28 H18 N2C 1 2/c 113.5559; 12.2134; 12.6643
90; 118.834; 90
1836.8Krause, Lennard; Herbst-Irmer, Regine; Stalke, Dietmar
An empirical correction for the influence of low-energy contamination
Journal of Applied Crystallography, 2015, 48, 1907-1913
2300560 CIF
HKL
Paper
C28 H18 N2C 1 2/c 113.5537; 12.2132; 12.6619
90; 118.836; 90
1836.1Krause, Lennard; Herbst-Irmer, Regine; Stalke, Dietmar
An empirical correction for the influence of low-energy contamination
Journal of Applied Crystallography, 2015, 48, 1907-1913
2300561 CIF
HKL
Paper
C28 H18 N2C 1 2/c 113.5559; 12.2134; 12.6643
90; 118.834; 90
1836.8Krause, Lennard; Herbst-Irmer, Regine; Stalke, Dietmar
An empirical correction for the influence of low-energy contamination
Journal of Applied Crystallography, 2015, 48, 1907-1913
2300562 CIF
HKL
Paper
C12 H4 N4C 1 2/c 18.896; 6.913; 16.439
90; 98.29; 90
1000.4Krause, Lennard; Herbst-Irmer, Regine; Stalke, Dietmar
An empirical correction for the influence of low-energy contamination
Journal of Applied Crystallography, 2015, 48, 1907-1913
2300563 CIF
HKL
Paper
C12 H4 N4C 1 2/c 18.884; 6.9036; 16.421
90; 98.241; 90
996.7Krause, Lennard; Herbst-Irmer, Regine; Stalke, Dietmar
An empirical correction for the influence of low-energy contamination
Journal of Applied Crystallography, 2015, 48, 1907-1913
2300564 CIF
HKL
Paper
C12 H4 N4C 1 2/c 18.896; 6.913; 16.439
90; 98.29; 90
1000.4Krause, Lennard; Herbst-Irmer, Regine; Stalke, Dietmar
An empirical correction for the influence of low-energy contamination
Journal of Applied Crystallography, 2015, 48, 1907-1913
2300565 CIF
HKL
Paper
C18 H17 Cu O6C 1 2/c 19.7935; 19.0055; 18.2997
90; 94.7996; 90
3394.2Krause, Lennard; Herbst-Irmer, Regine; Stalke, Dietmar
An empirical correction for the influence of low-energy contamination
Journal of Applied Crystallography, 2015, 48, 1907-1913
2300566 CIF
HKL
Paper
C18 H17 Cu O6C 1 2/c 19.7936; 18.9973; 18.2982
90; 94.84; 90
3392.3Krause, Lennard; Herbst-Irmer, Regine; Stalke, Dietmar
An empirical correction for the influence of low-energy contamination
Journal of Applied Crystallography, 2015, 48, 1907-1913
2300567 CIF
HKL
Paper
C18 H17 Cu O6C 1 2/c 19.7935; 19.0055; 18.2997
90; 94.7996; 90
3394.2Krause, Lennard; Herbst-Irmer, Regine; Stalke, Dietmar
An empirical correction for the influence of low-energy contamination
Journal of Applied Crystallography, 2015, 48, 1907-1913
2300568 CIF
HKL
Paper
C34 H26 Mg N4 O4P 1 21/n 111.3068; 14.9595; 16.7252
90; 93.05; 90
2825Krause, Lennard; Herbst-Irmer, Regine; Stalke, Dietmar
An empirical correction for the influence of low-energy contamination
Journal of Applied Crystallography, 2015, 48, 1907-1913
2300569 CIF
HKL
Paper
C34 H26 Mg N4 O4P 1 21/n 111.3182; 14.9745; 16.744
90; 93.044; 90
2833.8Krause, Lennard; Herbst-Irmer, Regine; Stalke, Dietmar
An empirical correction for the influence of low-energy contamination
Journal of Applied Crystallography, 2015, 48, 1907-1913
2300570 CIF
HKL
Paper
C34 H26 Mg N4 O4P 1 21/n 111.3068; 14.9595; 16.7252
90; 93.05; 90
2825Krause, Lennard; Herbst-Irmer, Regine; Stalke, Dietmar
An empirical correction for the influence of low-energy contamination
Journal of Applied Crystallography, 2015, 48, 1907-1913
2300571 CIF
HKL
Paper
C11 H10 O2 SP 21 21 215.9633; 9.0417; 18.4007
90; 90; 90
992.14Krause, Lennard; Herbst-Irmer, Regine; Stalke, Dietmar
An empirical correction for the influence of low-energy contamination
Journal of Applied Crystallography, 2015, 48, 1907-1913
2300572 CIF
HKL
Paper
C11 H10 O2 SP 21 21 215.9641; 9.0419; 18.4027
90; 90; 90
992.4Krause, Lennard; Herbst-Irmer, Regine; Stalke, Dietmar
An empirical correction for the influence of low-energy contamination
Journal of Applied Crystallography, 2015, 48, 1907-1913
2300573 CIF
HKL
Paper
C11 H10 O2 SP 21 21 215.9633; 9.0417; 18.4007
90; 90; 90
992.14Krause, Lennard; Herbst-Irmer, Regine; Stalke, Dietmar
An empirical correction for the influence of low-energy contamination
Journal of Applied Crystallography, 2015, 48, 1907-1913
2300574 CIF
Paper
C26 H19 P SP -110.215; 12.322; 17.351
101.57; 91.25; 112.02
1972.2Krause, Lennard; Herbst-Irmer, Regine; Stalke, Dietmar
An empirical correction for the influence of low-energy contamination
Journal of Applied Crystallography, 2015, 48, 1907-1913
2300575 CIF
Paper
C26 H19 P SP -110.215; 12.322; 17.351
101.57; 91.25; 112.02
1972.2Krause, Lennard; Herbst-Irmer, Regine; Stalke, Dietmar
An empirical correction for the influence of low-energy contamination
Journal of Applied Crystallography, 2015, 48, 1907-1913
2300588 CIF
HKL
C96 H126 Mg3 N36R -3 :H10.6769; 10.6769; 24.6539
90; 90; 120
2433.9Niepötter, Benedikt; Herbst-Irmer, Regine; Stalke, Dietmar
Empirical correction for resolution- and temperature-dependent errors caused by factors such as thermal diffuse scattering
Journal of Applied Crystallography, 2015, 48, 1485-1497
2300589 CIF
HKL
C96 H126 Mg3 N36R -3 :H10.6769; 10.6769; 24.6539
90; 90; 120
2433.9Niepötter, Benedikt; Herbst-Irmer, Regine; Stalke, Dietmar
Empirical correction for resolution- and temperature-dependent errors caused by factors such as thermal diffuse scattering
Journal of Applied Crystallography, 2015, 48, 1485-1497
2300590 CIF
HKL
C96 H126 Mg3 N36R -3 :H10.6769; 10.6769; 24.6539
90; 90; 120
2433.9Niepötter, Benedikt; Herbst-Irmer, Regine; Stalke, Dietmar
Empirical correction for resolution- and temperature-dependent errors caused by factors such as thermal diffuse scattering
Journal of Applied Crystallography, 2015, 48, 1485-1497
2300591 CIF
HKL
C96 H126 Mg3 N36R -3 :H10.6769; 10.6769; 24.6539
90; 90; 120
2433.9Niepötter, Benedikt; Herbst-Irmer, Regine; Stalke, Dietmar
Empirical correction for resolution- and temperature-dependent errors caused by factors such as thermal diffuse scattering
Journal of Applied Crystallography, 2015, 48, 1485-1497
2300592 CIF
HKL
C96 H126 Mg3 N36R -3 :H10.6712; 10.6712; 24.6546
90; 90; 120
2431.4Niepötter, Benedikt; Herbst-Irmer, Regine; Stalke, Dietmar
Empirical correction for resolution- and temperature-dependent errors caused by factors such as thermal diffuse scattering
Journal of Applied Crystallography, 2015, 48, 1485-1497
2300593 CIF
HKL
C96 H126 Mg3 N36R -3 :H10.6712; 10.6712; 24.6546
90; 90; 120
2431.4Niepötter, Benedikt; Herbst-Irmer, Regine; Stalke, Dietmar
Empirical correction for resolution- and temperature-dependent errors caused by factors such as thermal diffuse scattering
Journal of Applied Crystallography, 2015, 48, 1485-1497
2300594 CIF
HKL
C96 H126 Mg3 N36R -3 :H10.6712; 10.6712; 24.6546
90; 90; 120
2431.4Niepötter, Benedikt; Herbst-Irmer, Regine; Stalke, Dietmar
Empirical correction for resolution- and temperature-dependent errors caused by factors such as thermal diffuse scattering
Journal of Applied Crystallography, 2015, 48, 1485-1497
2300595 CIF
HKL
C96 H126 Mg3 N36R -3 :H10.6712; 10.6712; 24.6546
90; 90; 120
2431.4Niepötter, Benedikt; Herbst-Irmer, Regine; Stalke, Dietmar
Empirical correction for resolution- and temperature-dependent errors caused by factors such as thermal diffuse scattering
Journal of Applied Crystallography, 2015, 48, 1485-1497
2300596 CIF
HKL
C96 H126 Mg3 N36R -3 :H10.6434; 10.6434; 24.6108
90; 90; 120
2414.4Niepötter, Benedikt; Herbst-Irmer, Regine; Stalke, Dietmar
Empirical correction for resolution- and temperature-dependent errors caused by factors such as thermal diffuse scattering
Journal of Applied Crystallography, 2015, 48, 1485-1497
2300597 CIF
HKL
C96 H126 Mg3 N36R -3 :H10.6434; 10.6434; 24.6108
90; 90; 120
2414.4Niepötter, Benedikt; Herbst-Irmer, Regine; Stalke, Dietmar
Empirical correction for resolution- and temperature-dependent errors caused by factors such as thermal diffuse scattering
Journal of Applied Crystallography, 2015, 48, 1485-1497
2300598 CIF
HKL
C96 H126 Mg3 N36R -3 :H10.6434; 10.6434; 24.6108
90; 90; 120
2414.4Niepötter, Benedikt; Herbst-Irmer, Regine; Stalke, Dietmar
Empirical correction for resolution- and temperature-dependent errors caused by factors such as thermal diffuse scattering
Journal of Applied Crystallography, 2015, 48, 1485-1497
2300599 CIF
HKL
C96 H126 Mg3 N36R -3 :H10.6434; 10.6434; 24.6108
90; 90; 120
2414.4Niepötter, Benedikt; Herbst-Irmer, Regine; Stalke, Dietmar
Empirical correction for resolution- and temperature-dependent errors caused by factors such as thermal diffuse scattering
Journal of Applied Crystallography, 2015, 48, 1485-1497
2300600 CIF
HKL
C26 H19 P SP -110.225; 12.336; 17.371
101.58; 91.21; 111.99
1979.1Niepötter, Benedikt; Herbst-Irmer, Regine; Stalke, Dietmar
Empirical correction for resolution- and temperature-dependent errors caused by factors such as thermal diffuse scattering
Journal of Applied Crystallography, 2015, 48, 1485-1497
2300601 CIF
HKL
C26 H19 P SP -110.225; 12.336; 17.371
101.58; 91.21; 111.99
1979.1Niepötter, Benedikt; Herbst-Irmer, Regine; Stalke, Dietmar
Empirical correction for resolution- and temperature-dependent errors caused by factors such as thermal diffuse scattering
Journal of Applied Crystallography, 2015, 48, 1485-1497
2300602 CIF
HKL
C26 H19 P SP -110.225; 12.336; 17.371
101.58; 91.21; 111.99
1979.1Niepötter, Benedikt; Herbst-Irmer, Regine; Stalke, Dietmar
Empirical correction for resolution- and temperature-dependent errors caused by factors such as thermal diffuse scattering
Journal of Applied Crystallography, 2015, 48, 1485-1497
2300603 CIF
HKL
C26 H19 P SP -110.225; 12.336; 17.371
101.58; 91.21; 111.99
1979.1Niepötter, Benedikt; Herbst-Irmer, Regine; Stalke, Dietmar
Empirical correction for resolution- and temperature-dependent errors caused by factors such as thermal diffuse scattering
Journal of Applied Crystallography, 2015, 48, 1485-1497
2300604 CIF
HKL
C26 H19 P SP -110.223; 12.326; 17.357
101.55; 91.23; 112.05
1974.8Niepötter, Benedikt; Herbst-Irmer, Regine; Stalke, Dietmar
Empirical correction for resolution- and temperature-dependent errors caused by factors such as thermal diffuse scattering
Journal of Applied Crystallography, 2015, 48, 1485-1497
2300605 CIF
HKL
C26 H19 P SP -110.223; 12.326; 17.357
101.55; 91.23; 112.05
1974.8Niepötter, Benedikt; Herbst-Irmer, Regine; Stalke, Dietmar
Empirical correction for resolution- and temperature-dependent errors caused by factors such as thermal diffuse scattering
Journal of Applied Crystallography, 2015, 48, 1485-1497
2300606 CIF
HKL
C26 H19 P SP -110.223; 12.326; 17.357
101.55; 91.23; 112.05
1974.8Niepötter, Benedikt; Herbst-Irmer, Regine; Stalke, Dietmar
Empirical correction for resolution- and temperature-dependent errors caused by factors such as thermal diffuse scattering
Journal of Applied Crystallography, 2015, 48, 1485-1497
2300607 CIF
HKL
C26 H19 P SP -110.223; 12.326; 17.357
101.55; 91.23; 112.05
1974.8Niepötter, Benedikt; Herbst-Irmer, Regine; Stalke, Dietmar
Empirical correction for resolution- and temperature-dependent errors caused by factors such as thermal diffuse scattering
Journal of Applied Crystallography, 2015, 48, 1485-1497
2300608 CIF
HKL
C26 H19 P SP -110.213; 12.29; 17.335
101.62; 91.37; 112.09
1962.9Niepötter, Benedikt; Herbst-Irmer, Regine; Stalke, Dietmar
Empirical correction for resolution- and temperature-dependent errors caused by factors such as thermal diffuse scattering
Journal of Applied Crystallography, 2015, 48, 1485-1497
2300609 CIF
HKL
C26 H19 P SP -110.213; 12.29; 17.335
101.62; 91.37; 112.09
1962.9Niepötter, Benedikt; Herbst-Irmer, Regine; Stalke, Dietmar
Empirical correction for resolution- and temperature-dependent errors caused by factors such as thermal diffuse scattering
Journal of Applied Crystallography, 2015, 48, 1485-1497
2300610 CIF
HKL
C26 H19 P SP -110.213; 12.29; 17.335
101.62; 91.37; 112.09
1962.9Niepötter, Benedikt; Herbst-Irmer, Regine; Stalke, Dietmar
Empirical correction for resolution- and temperature-dependent errors caused by factors such as thermal diffuse scattering
Journal of Applied Crystallography, 2015, 48, 1485-1497
2310149 CIF
HKL
Paper
C60.41 H53.29 I6 N12 O2.44 Zn3C 1 2/c 134.346; 15.114; 32.5502
90; 103.415; 90
16436Ramadhar, Timothy R.; Zheng, Shao-Liang; Chen, Yu-Sheng; Clardy, Jon
Analysis of rapidly synthesized guest-filled porous complexes with synchrotron radiation: practical guidelines for the crystalline sponge method
Acta Crystallographica Section A, 2015, 71
2310150 CIF
HKL
C55.61 H47.39 Cl2.1 I6 N12 Zn3C 1 2/c 134.936; 14.9785; 30.825
90; 102.857; 90
15726Ramadhar, Timothy R.; Zheng, Shao-Liang; Chen, Yu-Sheng; Clardy, Jon
Analysis of rapidly synthesized guest-filled porous complexes with synchrotron radiation: practical guidelines for the crystalline sponge method
Acta Crystallographica Section A, 2015, 71
2310151 CIF
HKL
C411.01 H417.06 Cl1.65 I47.98 N96 O20.41 Zn23.99P 1 21 134.966; 14.8683; 66.99
90; 104.191; 90
33764Ramadhar, Timothy R.; Zheng, Shao-Liang; Chen, Yu-Sheng; Clardy, Jon
Analysis of rapidly synthesized guest-filled porous complexes with synchrotron radiation: practical guidelines for the crystalline sponge method
Acta Crystallographica Section A, 2015, 71
2310152 CIF
HKL
C37.44 H25.44 Cl4.32 I6 N12 Zn3C 1 2/c 134.655; 14.7307; 31.081
90; 101.031; 90
15573Ramadhar, Timothy R.; Zheng, Shao-Liang; Chen, Yu-Sheng; Clardy, Jon
Analysis of rapidly synthesized guest-filled porous complexes with synchrotron radiation: practical guidelines for the crystalline sponge method
Acta Crystallographica Section A, 2015, 71
2310153 CIF
HKL
Paper
C32 H36 N8 O7 SP -18.4454; 10.9223; 18.4436
90.268; 94.002; 106.255
1628.78van de Streek, Jacco
Structure of Pigment Yellow 181 dimethylsulfoxide N-methyl-2-pyrrolidone (1:1:1) solvate from XRPD + DFT-D.
Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 89-94
2310154 CIF
HKL
Paper
As39.51 Pb6.13 S136 Sb41.51 Tl16.85P 18.5197; 42.461; 16.293
83.351; 90.958; 84.275
5823Biagioni, Cristian; Moëlo, Yves; Favreau, Georges; Bourgoin, Vincent; Boulliard, Jean Claude
Structure of Pb-rich chabournéite from Jas Roux, France.
Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 81-88
2310155 CIF
HKL
Paper
C0.6 O49.2 Si24P 1 21/n 113.376; 20.111; 19.878
90; 90.003; 90
5347.3Fujiyama, Shinjiro; Yoza, Kenji; Kamiya, Natsumi; Nishi, Koji; Yokomori, Yoshinobu
Entrance and diffusion pathway of CO2 and dimethyl ether in silicalite-1 zeolite channels as determined by single-crystal XRD structural analysis
Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 112-118
2310156 CIF
HKL
Paper
C0.14 O48.27 Si24P 1 21/n 113.383; 20.118; 19.887
90; 90.049; 90
5354.4Fujiyama, Shinjiro; Yoza, Kenji; Kamiya, Natsumi; Nishi, Koji; Yokomori, Yoshinobu
Entrance and diffusion pathway of CO2 and dimethyl ether in silicalite-1 zeolite channels as determined by single-crystal XRD structural analysis
Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 112-118
2310157 CIF
HKL
Paper
C0.6 O49.2 Si24P 1 21/n 113.388; 20.132; 19.902
90; 90.04; 90
5364.1Fujiyama, Shinjiro; Yoza, Kenji; Kamiya, Natsumi; Nishi, Koji; Yokomori, Yoshinobu
Entrance and diffusion pathway of CO2 and dimethyl ether in silicalite-1 zeolite channels as determined by single-crystal XRD structural analysis
Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 112-118
2310158 CIF
HKL
Paper
C1.1 O50.2 Si24P 1 21/n 113.383; 20.121; 19.881
90; 90.057; 90
5353.5Fujiyama, Shinjiro; Yoza, Kenji; Kamiya, Natsumi; Nishi, Koji; Yokomori, Yoshinobu
Entrance and diffusion pathway of CO2 and dimethyl ether in silicalite-1 zeolite channels as determined by single-crystal XRD structural analysis
Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 112-118
2310159 CIF
HKL
Paper
C1.1 O48.5 Si24P 1 21/n 113.386; 20.106; 19.881
90; 90.02; 90
5350.8Fujiyama, Shinjiro; Yoza, Kenji; Kamiya, Natsumi; Nishi, Koji; Yokomori, Yoshinobu
Entrance and diffusion pathway of CO2 and dimethyl ether in silicalite-1 zeolite channels as determined by single-crystal XRD structural analysis
Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 112-118
2310160 CIF
HKL
Paper
C2 O49 Si24P 1 21/n 113.381; 20.107; 19.875
90; 90.023; 90
5347.4Fujiyama, Shinjiro; Yoza, Kenji; Kamiya, Natsumi; Nishi, Koji; Yokomori, Yoshinobu
Entrance and diffusion pathway of CO2 and dimethyl ether in silicalite-1 zeolite channels as determined by single-crystal XRD structural analysis
Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 112-118
2310161 CIF
HKL
Paper
C0.4 O48.2 Si24P 1 21/n 113.383; 20.108; 19.877
90; 90.003; 90
5349Fujiyama, Shinjiro; Yoza, Kenji; Kamiya, Natsumi; Nishi, Koji; Yokomori, Yoshinobu
Entrance and diffusion pathway of CO2 and dimethyl ether in silicalite-1 zeolite channels as determined by single-crystal XRD structural analysis
Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 112-118
2310162 CIF
HKL
Paper
C0.5 O48.2 Si24P 1 21/n 113.385; 20.11; 19.881
90; 90.041; 90
5351.4Fujiyama, Shinjiro; Yoza, Kenji; Kamiya, Natsumi; Nishi, Koji; Yokomori, Yoshinobu
Entrance and diffusion pathway of CO2 and dimethyl ether in silicalite-1 zeolite channels as determined by single-crystal XRD structural analysis
Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 112-118
2310163 CIF
HKL
Paper
C4 H16 Ca O12P 21 21 27.739; 12.803; 5.829
90; 90; 90
577.551Ventruti, Gennaro; Scordari, Fernando; Bellatreccia, Fabio; Della Ventura, Giancarlo; Sodo, Armida
Calcium tartrate esahydrate, CaC4H4O6·6H2O: a structural and spectroscopic study.
Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 68-73
2310766 CIF
Paper
C18 H10 Cl2 N2 O4P 1 21 112.372; 3.7649; 16.831
90; 107.789; 90
746.49Noohinejad, Leila; Mondal, Swastik; Ali, Sk Imran; Dey, Somnath; van Smaalen, Sander; Schönleber, Andreas
Resonance-stabilized partial proton transfer in hydrogen bonds of incommensurate phenazine-chloranilic acid
Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 228-234
2310767 CIF
Paper
B3.041 O10.479 Si0.959 Sr4P n m a12.2774; 3.9006; 5.4091
90; 90; 90
259.038Volkov, Sergey; Bubnova, Rimma; Bolotina, Nadezhda; Krzhizhanovskaya, Maria; Belousova, Olga; Filatov, Stanislav
Incommensurate modulation and thermal expansion of Sr~3~B~2+x~Si~1-x~O~8-x/2 solid solutions
Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 489-497
2310768 CIF
Paper
B3.376 O10.312 Si0.624 Sr4P n m a12.178; 3.8801; 5.387
90; 90; 90
254.55Volkov, Sergey; Bubnova, Rimma; Bolotina, Nadezhda; Krzhizhanovskaya, Maria; Belousova, Olga; Filatov, Stanislav
Incommensurate modulation and thermal expansion of Sr~3~B~2+x~Si~1-x~O~8-x/2 solid solutions
Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 489-497
2310769 CIF
Paper
B3.704 O10.148 Si0.296 Sr4P n m a12.089; 3.8635; 5.378
90; 90; 90
251.184Volkov, Sergey; Bubnova, Rimma; Bolotina, Nadezhda; Krzhizhanovskaya, Maria; Belousova, Olga; Filatov, Stanislav
Incommensurate modulation and thermal expansion of Sr~3~B~2+x~Si~1-x~O~8-x/2 solid solutions
Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 489-497
2310780 CIF
Paper
Bi0.097 Fe1.049 O2.585 Pb0.856I 1 2/m 13.93492; 3.93193; 4.00171
90; 92.603; 90
61.85Batuk, Dmitry; Batuk, Maria; Abakumov, Artem M.; Hadermann, Joke
Synergy between transmission electron microscopy and powder diffraction: application to modulated structures.
Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 127-143
2310781 CIF
Paper
Bi0.195 Fe1.046 O2.633 Pb0.763I 1 2/m 13.92822; 3.92661; 4.05202
90; 92.209; 90
62.454Batuk, Dmitry; Batuk, Maria; Abakumov, Artem M.; Hadermann, Joke
Synergy between transmission electron microscopy and powder diffraction: application to modulated structures.
Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 127-143
2310782 CIF
Paper
Bi0.292 Fe1.042 O2.675 Pb0.671I 1 2/m 13.92131; 3.91951; 4.09255
90; 91.913; 90
62.866Batuk, Dmitry; Batuk, Maria; Abakumov, Artem M.; Hadermann, Joke
Synergy between transmission electron microscopy and powder diffraction: application to modulated structures.
Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 127-143
2310783 CIF
Paper
Bi0.428 Fe1.034 O2.736 Pb0.541I 1 2/m 13.9146; 3.91271; 4.13775
90; 91.554; 90
63.353Batuk, Dmitry; Batuk, Maria; Abakumov, Artem M.; Hadermann, Joke
Synergy between transmission electron microscopy and powder diffraction: application to modulated structures.
Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 127-143
2310784 CIF
Paper
Bi0.545 Fe1.027 O2.783 Pb0.428I 1 2/m 13.90908; 3.90585; 4.16564
90; 91.318; 90
63.585Batuk, Dmitry; Batuk, Maria; Abakumov, Artem M.; Hadermann, Joke
Synergy between transmission electron microscopy and powder diffraction: application to modulated structures.
Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 127-143
2310785 CIF
Paper
Al4.8 O9.6 Si1.2P b a m7.5911; 7.6924; 2.8899
90; 90; 90
168.752Birkenstock, Johannes; Petříček, Václav; Pedersen, Bjoern; Schneider, Hartmut; Fischer, Reinhard X.
The modulated average structure of mullite.
Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 358-368
2310786 CIF
Paper
Al4.78 O9.61 Si1.22P b a m7.5757; 7.6651; 2.885
90; 90; 90
167.528Birkenstock, Johannes; Petříček, Václav; Pedersen, Bjoern; Schneider, Hartmut; Fischer, Reinhard X.
The modulated average structure of mullite.
Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 358-368
2311042 CIFCl NaF m -3 m5.62; 5.62; 5.62
90; 90; 90
177.504Juhás, Pavol; Farrow, Christopher L.; Yang, Xiaohao; Knox, Kevin R.; Billinge, Simon J. L.
Complex modeling: a strategy and software program for combining multiple information sources to solve ill posed structure and nanostructure inverse problems
Acta Crystallographica Section A, 2015, 71, 562-568
2311272 CIF
Paper
H18 Mg O13 SeP 1 21/c 17.2223; 10.483; 17.327
90; 109.573; 90
1236Fortes, A. Dominic; Alfè, Dario; Hernández, Eduardo R; Gutmann, Matthias J.
Structure of magnesium selenate enneahydrate, MgSeO4·9H2O, from 5 to 250 K using neutron time-of-flight Laue diffraction.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2015, 71, 313-327
2311273 CIF
Paper
H18 Mg O13 SeP 1 21/c 17.2264; 10.487; 17.33
90; 109.579; 90
1237.4Fortes, A. Dominic; Alfè, Dario; Hernández, Eduardo R; Gutmann, Matthias J.
Structure of magnesium selenate enneahydrate, MgSeO4·9H2O, from 5 to 250 K using neutron time-of-flight Laue diffraction.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2015, 71, 313-327
2311274 CIF
Paper
H18 Mg O13 SeP 1 21/c 17.2389; 10.497; 17.349
90; 109.522; 90
1242.5Fortes, A. Dominic; Alfè, Dario; Hernández, Eduardo R; Gutmann, Matthias J.
Structure of magnesium selenate enneahydrate, MgSeO4·9H2O, from 5 to 250 K using neutron time-of-flight Laue diffraction.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2015, 71, 313-327
2311275 CIF
Paper
H18 Mg O13 SeP 1 21/c 17.2604; 10.502; 17.388
90; 109.423; 90
1250.4Fortes, A. Dominic; Alfè, Dario; Hernández, Eduardo R; Gutmann, Matthias J.
Structure of magnesium selenate enneahydrate, MgSeO4·9H2O, from 5 to 250 K using neutron time-of-flight Laue diffraction.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2015, 71, 313-327
2311278 CIF
Paper
C17 H12 Cl4 F N O4P 21 21 219.965; 10.982; 16.926
90; 90; 90
1852.3Zhong, Jia-Liang; Hou, Jia-Wei; Liu, Li-Hong; Liu, He
Crystal structure of 1,7,8,9-tetra-chloro-4-(2-fluoro-benz-yl)-10,10-dimeth-oxy-4-aza-tri-cyclo-[5.2.1.0(2,6)]dec-8-ene-3,5-dione.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, o32
2311279 CIF
Paper
C10 H15 Cl3 Ir NP 21 21 218.25131; 11.85605; 12.9415
90; 90; 90
1266.04Morris, David M.; Merola, Joseph S.
Serendipitous preparation of fac-(aceto-nitrile-κN)tri-chlorido-[(1,2,5,6-η)-cyclo-octa-1,5-diene]iridium(III).
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, 371-373
2311280 CIF
Paper
H6 N4 O4 PtP 1 21/c 16.8656; 12.6428; 7.0931
90; 110.579; 90
576.4Kahlenberg, Volker; Gelbrich, Thomas; Tessadri, Richard; Klauser, Frederik
Crystal structure of cis-diamminebis(nitrito-κN)platinum(II).
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, 366-370
2311281 CIF
Paper
C14 H14 N4C 1 2/c 119.347; 5.9339; 13.165
90; 122.266; 90
1278Abdoh, Muneer; Warad, Ismail; Naveen, S.; Lokanath, N. K.; Salghi, Rachid
Crystal structure of (1E,1'E)-N,N'-(ethane-1,2-di-yl)bis-[(pyridin-2-yl)methanimine].
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, o431
2311282 CIF
Paper
C15 H15 N3 S2P 1 21/c 18.1035; 12.0193; 15.1312
90; 94.347; 90
1469.52Naveen, S.; Pavithra, G.; Abdoh, Muneer; Ajay Kumar, K.; Warad, Ismail; Lokanath, N. K.
Crystal structure of 3-(thio-phen-2-yl)-5-p-tolyl-4,5-di-hydro-1H-pyrazole-1-carbo-thio-amide.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, 763-765
2311283 CIF
Paper
C10 H10 O4P b c a7.754; 11.346; 21.187
90; 90; 90
1864Saranya, Matheswaran; Subashini, Annamalai; Arunagiri, Chidambaram; Muthiah, Packianathan Thomas
Crystal structure of 3-acet-oxy-2-methyl-benzoic acid.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, o474
2311284 CIF
Paper
C17 H18 N2 O3 S2P 1 21/c 17.8835; 14.4041; 15.231
90; 94.94; 90
1723.1Prasad, N. L.; Krishnamurthy, M. S.; Begum, Noor Shahina
Crystal structure of ethyl 2-acetyl-3,7-dimethyl-5-(thio-phen-2-yl)-5H-thia-zolo[3,2-a]pyrimidine-6-carboxyl-ate.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, o477-8
2311285 CIF
Paper
C21 H16 N2 O2I 1 2/a 120.6017; 6.1461; 25.9689
90; 94.332; 90
3278.8Mohamed, Shaaban K.; Horton, Peter N.; Akkurt, Mehmet; Younes, Sabry H. H.; Albayati, Mustafa R.
Crystal structure of 3-amino-1-(4-meth-oxy-phen-yl)-1H-benzo[f]chromene-2-carbo-nitrile.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, o468-9
2311286 CIF
Paper
C20 H13 Cl N2 OP 1 21 110.056; 6.172; 12.751
90; 99.641; 90
780.2Akkurt, Mehmet; Horton, Peter N.; Mohamed, Shaaban K.; Younes, Sabry H. H.; Albayati, Mustafa R.
Crystal structure of 3-amino-1-(4-chloro-phen-yl)-1H-benzo[f]chromene-2-carbo-nitrile.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, o481-2
2311287 CIF
Paper
C20 H14 N2 OP 1 21 19.1662; 5.7246; 13.9177
90; 90.153; 90
730.298Mohamed, Shaaban K.; Horton, Peter N.; Akkurt, Mehmet; Younes, Sabry H. H.; Albayati, Mustafa R.
Crystal structure of 2-amino-4-phenyl-4H-benzo[h]chromene-3-carbo-nitrile.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, o516-7
2311288 CIF
Paper
C21 H21 N O5P -18.3444; 9.3508; 12.2723
104.079; 97.282; 93.904
916.43Shrungesh Kumar, T. O.; Naveen, S.; Kumara, M. N.; Mahadevan, K. M.; Lokanath, N. K.
Crystal structure of ethyl 2-(2,4,5-tri-meth-oxy-phen-yl)quinoline-4-carboxyl-ate.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, o514-5
2311289 CIF
Paper
C19 H22 N6 O2 S2C 1 2/c 119.3941; 12.711; 10.145
90; 103.306; 90
2433.79Mague, Joel T.; Mohamed, Shaaban K.; Akkurt, Mehmet; Younes, Sabry H. H.; Albayati, Mustafa R.
Crystal structure of [(E)-({2-[3-(2-{(1E)-[(carbamo-thioyl-amino)-imino]-meth-yl}phen-oxy)prop-oxy]phen-yl}methyl-idene)amino]-thio-urea with an unknown solvate.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, o530-1
2311290 CIF
Paper
C18 H22 N2 SP -17.616; 8.3267; 13.9011
84.999; 77.631; 74.347
828.75Zhou, Xin-Bo; Gu, Jian-Ming; Sun, Meng-Ying; Hu, Xiu-Rong; Wu, Su-Xiang
Crystal structures of vortioxetine and its methanol monosolvate.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, 883-885
2311291 CIF
Paper
C19 H26 N2 O SP 1 21/c 113.21; 18.15; 8.1746
90; 104.378; 90
1898.57Zhou, Xin-Bo; Gu, Jian-Ming; Sun, Meng-Ying; Hu, Xiu-Rong; Wu, Su-Xiang
Crystal structures of vortioxetine and its methanol monosolvate.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, 883-885
2311292 CIF
Paper
C7 H10 N O1.5A e a 212.4859; 14.3697; 7.732
90; 90; 90
1387.3Nguyen, Dalena M.; Desikan, Vasumathi; Golen, James A.; Manke, David R.
Crystal structure of 2,6-dimethyl-4-pyridone hemihydrate.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, o533
2311293 CIF
Paper
C16 H12 N2 O3C 1 2/c 118.3084; 6.0743; 24.5339
90; 106.471; 90
2616.5Horton, Peter N.; Akkurt, Mehmet; Mohamed, Shaaban K.; Younes, Sabry H. H.; Albayati, Mustafa R.
Crystal structure of 2-amino-7-hy-droxy-4-(4-hy-droxy-phen-yl)-4H-chromene-3-carbo-nitrile.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, o546-7
2311294 CIF
Paper
C11 H6 Br Cl O3P 1 21/c 112.577; 5.7977; 14.839
90; 94.679; 90
1078.42Chennuru, Ramanaiah; Maddimsetti, Balaji; Gundlapalli, Suman; Babu, R. Ravi Chandra; Mahapatra, Sudarshan
Crystal structure of 3-bromo-acetyl-6-chloro-2H-1-benzo-pyran-2-one.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, o615-6
2311295 CIF
Paper
C14 H14 Cl N3 O2P 1 21/c 113.0977; 7.4932; 14.1123
90; 90.149; 90
1385.03Aydın, Abdullah; Akkurt, Mehmet; Şüküroğlu, Murat; Büyükgüngör, Orhan
Crystal structure of 4-(4-chloro-phen-yl)-6-(morpholin-4-yl)pyridazin-3(2H)-one.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, 944-946
2311296 CIFH14.5 K5.5 Mo6 O30 PtC m c e16.8552; 22.7112; 15.5503
90; 90; 90
5952.7Joo, Hea-Chung; Park, Ki-Min; Lee, Uk
Crystal structure of undeca-potassium bis-[α-hemi-penta-hydrogen hexa-molybdoplatinate(IV)] dodeca-hydrate.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, 986-988
2311297 CIF
Paper
C25 H14 F3 N3 O3P 1 21/n 19.7665; 7.795; 27.0602
90; 95.186; 90
2051.66Chandra, ?; Kumar, Shamantha; Puttaraju, K. B.; Shivashankar, K.; Mahendra, M.
Crystal structure of 10-[(3-oxo-3H-benzo[f]chromen-1-yl)meth-yl]-2-tri-fluoro-methyl-9a,10-di-hydro-benz[4,5]imidazo[1,2-a]pyrimidin-4(5aH)-one.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, o672-3
2311298 CIF
Paper
C11 H10 Cl N3 O2P 1 21/c 18.6844; 10.8112; 11.9235
90; 95.2046; 90
1114.87Jasmine, N. Jeeva; Rajam, A.; Muthiah, P. Thomas; Stanley, N.; Razak, I. Abdul; Rosli, M. Mustaqim
Crystal structure of 2-amino-pyridinium 6-chloro-nicotinate.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, o655-6
2311299 CIFC15 H21 Cl2 N3 O Ru SC 1 2/c 114.6117; 9.3345; 27.3451
90; 102.734; 90
3637.94Trotter, Kasey; Arulsamy, Navamoney; Hulley, Elliott
Crystal structure of cis,fac-{N,N-bis-[(pyridin-2-yl)meth-yl]methyl-amine-κ(3) N,N',N''}di-chlorido-(dimethyl sulfoxide-κS)ruthenium(II).
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, m169-70
2311300 CIF
Paper
C14 H15 F N2 O2 SP -18.9298; 11.587; 15.7459
100.94; 104.804; 98.153
1515.12Krishnamurthy, M. S.; Begum, Noor Shahina
Crystal structure of ethyl 4-(2-fluoro-phen-yl)-6-methyl-2-sulfanyl-idene-1,2,3,4-tetra-hydro-pyrimidine-5-carboxyl-ate.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, o699-700
2311301 CIF
Paper
C13 H14 N2 O3P -110.2314; 11.0693; 11.3254
91.736; 98.695; 105.345
1219.4Benaka Prasad, S. B.; Naveen, S.; Madaiah, M.; Lokanath, N. K.; Warad, Ismail; Abdoh, Muneer
Crystal structure of 1'-ethyl-spiro[chroman-4,4'-imidazolidine]-2',5'-dione: a hydantoine derivative.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, o705-6
2311302 CIF
Paper
C13 H18 N2 O3 SP b c a12.218; 7.332; 30.923
90; 90; 90
2770.2Prasad, N. L.; Krishnamurthy, M. S.; Nagarajaiah, H.; Begum, Noor Shahina
Crystal structure of ethyl 5-acetyl-2-{[(di-methyl-amino)-methyl-idene]amino}-4-methyl-thio-phene-3-carboxyl-ate.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, o762-3
2311303 CIF
Paper
C21 H25 Cl N2 O5 SP -19.9; 11.8563; 19.0377
80.827; 83.999; 86.071
2190.9Prasad, N. L.; Krishnamurthy, M. S.; Begum, Noor Shahina
Crystal structure of 2-acetyl-5-(3,4-di-meth-oxy-phen-yl)-6-eth-oxy-carbonyl-3,7-dimethyl-5H-thia-zolo[3,2-a]pyrimidin-8-ium chloride.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, o764-5
2311304 CIF
Paper
C44 H44 Au2 Fe N2 P2 S4P 1 21/c 110.9635; 14.972; 13.0087
90; 102.977; 90
2080.78Tan, Yee Seng; Tiekink, Edward R. T.
Crystal structure of [μ2-1,1'-bis-(di-phenyl-phos-phanyl)ferrocene-κ(2) P:P']bis-[(pyrrolidine-1-carbo-dithioato-κS)gold(I)].
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, 1143-1146
2311305 CIF
Paper
C14 H8 Ag2 Mn N6P 31 1 28.7215; 8.7215; 20.9874
90; 90; 120
1382.52Theppitak, Chatphorn; Chainok, Kittipong
Crystal structure of poly[(2,2'-bi-pyridine-κ(2) N,N')tetra-μ2-cyanido-κ(4) C:N;κ(4) N:C-manganese(II)disilver(I)].
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, m179-80
2311306 CIF
Paper
C17 H17 N5P 1 21/c 15.145; 15.1359; 19.5828
90; 96.547; 90
1515.05Jasinski, Jerry P.; Akkurt, Mehmet; Mohamed, Shaaban K.; Abdu-Allah, Hajjaj H M; Albayati, Mustafa R.
Crystal structure of 3-methyl-1-phenyl-6-propyl-amino-1H-pyrazolo[3,4-b]pyridine-5-carbo-nitrile.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, o766-7
2311307 CIF
Paper
C14 H11 N5 O S2P c a 2116.271; 5.3804; 16.7
90; 90; 90
1462Vaarla, Krishnaiah; Rao, V. Rajeswar; Akkurt, Mehmet
Crystal structure of 3-benzyl-sulfanyl-6-(5-methyl-1,2-oxazol-3-yl)-1,2,4-triazolo[3,4-b][1,3,4]thia-diazole.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, o809-10
2311308 CIF
Paper
C17 H17 N3 O3 SP 1 21/n 15.5215; 16.1299; 18.7112
90; 93.98; 90
1662.42Akkurt, Mehmet; Smolenski, Victoria A.; Mohamed, Shaaban K.; Jasinski, Jerry P.; Hassan, Alaa A.; Albayati, Mustafa R.
Crystal structure of methyl (2Z)-2-[(2Z)-2-(2-cyclo-pentyl-idenehydrazin-1-yl-idene)-4-oxo-3-phenyl-1,3-thia-zolidin-5-yl-idene]ethano-ate.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, o776-7
2311309 CIF
Paper
C54 H64 O12 S4P -110.9366; 11.7386; 12.6262
100.018; 113.884; 105.884
1348.75Akkurt, Mehmet; Jasinski, Jerry P.; Mohamed, Shaaban K.; Omran, Omran A.; Albayati, Mustafa R.
Crystal structure of tetra-ethyl 27,30-dioxo-7,12,20,25-tetra-tert-but-yl-3,16-dioxa-9,22,28,31-tetra-thia-hepta-cyclo-[21.3.1.1(1,5).1(4,8).1(10,14).1(14,18).1(17,21)]dotriaconta-4,6,8(29),10,12,17,19,21(32),23,25-deca-ene-2,2,15,15-tetra-carboxyl-ate.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, o778-9
2311310 CIFC17 H13 N O3P 1 21/c 16.716; 6.809; 29.425
90; 94.784; 90
1340.9Gomes, Ligia R.; Low, John Nicolson; Cagide, Fernando; Gaspar, Alexandra; Borges, Fernanda
A comparison of the structures of some 2- and 3-substituted chromone derivatives: a structural study on the importance of the secondary carboxamide backbone for the inhibitory activity of MAO-B.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, 1270-1277
2311311 CIFC14 H13 N O3P 21 21 217.43; 11.963; 12.648
90; 90; 90
1124.2Gomes, Ligia R.; Low, John Nicolson; Cagide, Fernando; Gaspar, Alexandra; Borges, Fernanda
A comparison of the structures of some 2- and 3-substituted chromone derivatives: a structural study on the importance of the secondary carboxamide backbone for the inhibitory activity of MAO-B.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, 1270-1277
2311312 CIFC14 H13 N O3A e a 215.337; 21.94; 6.808
90; 90; 90
2290.8Gomes, Ligia R.; Low, John Nicolson; Cagide, Fernando; Gaspar, Alexandra; Borges, Fernanda
A comparison of the structures of some 2- and 3-substituted chromone derivatives: a structural study on the importance of the secondary carboxamide backbone for the inhibitory activity of MAO-B.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, 1270-1277
2311313 CIF
Paper
C15 H15 F N2 O SC 1 c 111.213; 14.231; 9.582
90; 116.76; 90
1365Chandra Kumar, K.; Umesh, V.; Madhura, T. K.; Rajesh, B. M.; Chandra, ?
Crystal structure of 2-amino-N-(2-fluoro-phen-yl)-4,5,6,7-tetra-hydro-1-benzo-thio-phene-3-carboxamide.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, o807-8
2311314 CIF
Paper
C21 H19 N3 O3 SP 1 21/n 113.143; 8.013; 17.88
90; 96.129; 90
1872.3Akkurt, Mehmet; Smolenski, Victoria A.; Mohamed, Shaaban K.; Jasinski, Jerry P.; Ahmed, Essam K.; Albayati, Mustafa R.
Crystal structure of ethyl 2-phenyl-4-(prop-2-yn-1-yl-oxy)-5,6,7,8-tetra-hydro-pyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7-carboxyl-ate.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, o836-7
2311315 CIF
Paper
C56 H74 Cl N O5 S4P 1 21 119.4338; 14.2147; 20.8631
90; 103.184; 90
5611.4Akkurt, Mehmet; Jasinski, Jerry P.; Mohamed, Shaaban K.; Omran, Omran A.; Albayati, Mustafa R.
Crystal structure of the inclusion complex 25-benzo-ylmeth-oxy-5,11,17,23-tetra-tert-butyl-26,27,28-trihy-droxy-2,8,14,20-tetra-thia-calix[4]arene-tetra-ethyl-ammonium chloride (1/1).
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, o830-1
2311316 CIF
Paper
C13 H13 F N2 O2 SP 1 21/n 113.3298; 7.1509; 14.5703
90; 109.854; 90
1306.3Krishnamurthy, M. S.; Begum, Noor Shahina
Crystal structure of methyl 4-(2-fluoro-phenyl)-6-methyl-2-sulfanylidene-1,2,3,4-tetra-hydro-pyrimidine-5-carb-oxy-late.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, o838-9
2311317 CIF
Paper
C16 H23 N3 O3 SP -17.6954; 8.1799; 13.9626
95.928; 103.685; 90.137
849.07Krishnamurthy, M. S.; Prasad, N. L.; Nagarajaiah, H.; Begum, Noor Shahina
Crystal structure of ethyl 5-[3-(di-methyl-amino)-acrylo-yl]-2-{[(di-methyl-amino)-methyl-idene]-amino}-4-methylthio-phene-3-carb-oxy-late.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, o908-9
2311318 CIF
Paper
C7 H7 Br N2C 1 2/m 113.3039; 6.5892; 9.3753
90; 92.419; 90
821.13Nguyen, Vu D.; McCormick, Cameron A.; Pascal, Jr, Robert A; Mague, Joel T.; Koplitz, Lynn V.
Crystal structure of 2-cyano-1-methyl-pyridinium bromide.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, o854-5
2311319 CIF
Paper
C17 H13 N O5P 21 21 216.8118; 13.6726; 15.909
90; 90; 90
1481.7Walki, Shashikanth; Naveen, S.; Kenchanna, S.; Mahadevan, K. M.; Kumara, M. N.; Lokanath, N. K.
Crystal structure of 8-eth-oxy-3-(4-nitro-phen-yl)-2H-chromen-2-one.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, o860-1
2311320 CIF
Paper
C13 H14 N2 O3P 1 21/c 110.9754; 12.9877; 8.9544
90; 96.546; 90
1268.09Mocilac, Pavle; Gallagher, John F.
Two isostructural carbamates: the o-tolyl N-(pyridin-3-yl)carbamate and 2-bromo-phenyl N-(pyridin-3-yl)carbamate monohydrates.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, 1366-1370
2311321 CIF
Paper
C12 H11 Br N2 O3P 1 21/c 110.9036; 13.0518; 8.9804
90; 96.46; 90
1269.9Mocilac, Pavle; Gallagher, John F.
Two isostructural carbamates: the o-tolyl N-(pyridin-3-yl)carbamate and 2-bromo-phenyl N-(pyridin-3-yl)carbamate monohydrates.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, 1366-1370
2311322 CIF
Paper
C15 H20 O6P 21 21 218.198; 10.029; 16.772
90; 90; 90
1378.96Çelik, Ísmail; Akkurt, Mehmet; Akşit, Hüseyin; Erenler, Ramazan; García-Granda, Santiago
Crystal structure and computational study of 3,4-dihy-droxy-3-hy-droxy-methyl-9-methyl-6-methyl-idene-3a,4,5,6,6a,9,9a,9b-octa-hydro-azuleno[4,5-b]furan-2,8(3H,7H)-dione.
Acta crystallographica. Section E, Crystallographic communications, 2015, 71, 1425-1428

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