Crystallography Open Database

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2243062 CIF
HKL
Paper
C17 H16 O4P 1 21/n 112.0914; 9.4741; 12.7761
90; 92.943; 90
1461.64Martínez-Cabrera, Miguel A.; Macías, Mario A.; Ferreira, Francisco; Pandolfi, Enrique; Barúa, Javier; Suescun, Leopoldo
Crystal structure and Hirshfeld surface analysis of lapachol acetate 80 years after its first synthesis
Acta Crystallographica Section E, 2019, 75, 1362-1366
2243063 CIF
HKL
Paper
C32 H51 N O6C 1 2 134.882; 6.5332; 13.6021
90; 100.599; 90
3046.9Suescun, Leopoldo; Heinzen, Horacio
Absolute structure of (3a<i>S</i>,5<i>S</i>,7a<i>S</i>,7b<i>S</i>,9a<i>R</i>,10<i>R</i>,12a<i>R</i>,12b<i>S</i>)-7b-hydroxy-4,4,7a,9a,12a-pentamethyl-10-[(2'<i>R</i>)-6-methylheptan-2-yl]-2,8,9-trioxooctadecahydrobenzo[<i>d</i>]indeno[4,5-<i>b</i>]azepin-5-yl acetate from 62-year-old crystals
Acta Crystallographica Section E, 2019, 75, 1348-1351
2243064 CIF
HKL
Paper
C11 H9 F3 N4 SP n a 217.6595; 20.9841; 7.8641
90; 90; 90
1263.98Slyvka, Yurii; Goreshnik, Evgeny; Pokhodylo, Nazariy; Mys`kiv, Marian
Crystal structure, Hirshfeld surface analysis and computational studies of 5-[(prop-2-en-1-yl)sulfanyl]-1-[2-(trifluoromethyl)phenyl]-1<i>H</i>-tetrazole
Acta Crystallographica Section E, 2019, 75, 1331-1335
2243065 CIF
HKL
Paper
C15 H17 N5P 1 21/n 110.6043; 9.4168; 16.4423
90; 107.886; 90
1562.55Bogdanov, Georgii; Tillotson, John P.; Bustos, Jenna; Fonari, Marina; Timofeeva, Tatiana V.
Crystal structure of tetramethylammonium 1,1,7,7-tetracyanohepta-2,4,6-trienide
Acta Crystallographica Section E, 2019, 75, 1344-1347
2243066 CIF
HKL
Paper
C18 H16 N2 OP -15.8479; 8.5738; 15.2439
80.693; 83.147; 78.164
735.27Daoui, Said; Cinar, Emine Berrin; El Kalai, Fouad; Saddik, Rafik; Karrouchi, Khalid; Benchat, Noureddine; Baydere, Cemile; Dege, Necmi
Crystal structure and Hirshfeld surface analysis of 4-(4-methylbenzyl)-6-phenylpyridazin-3(2<i>H</i>)-one
Acta Crystallographica Section E, 2019, 75, 1352-1356
2243067 CIF
HKL
C11 H11 N O2 SP -19.2784; 10.7925; 11.6696
74.464; 74.179; 85.073
1083.11Al-Refai, Mahmoud; Ali, Basem F.; Said, Ala'a B.; Geyer, Armin; Marsch, Michael; Harms, Klaus
Synthesis, characterization, crystal structure and supramolecularity of ethyl (<i>E</i>)-2-cyano-3-(3-methylthiophen-2-yl)acrylate and a new polymorph of ethyl (<i>E</i>)-2-cyano-3-(thiophen-2-yl)acrylate
Acta Crystallographica Section E, 2019, 75, 1357-1361
2243068 CIF
HKL
C10 H9 N O2 SP 1 21/c 111.5907; 6.6883; 13.4837
90; 107.859; 90
994.92Al-Refai, Mahmoud; Ali, Basem F.; Said, Ala'a B.; Geyer, Armin; Marsch, Michael; Harms, Klaus
Synthesis, characterization, crystal structure and supramolecularity of ethyl (<i>E</i>)-2-cyano-3-(3-methylthiophen-2-yl)acrylate and a new polymorph of ethyl (<i>E</i>)-2-cyano-3-(thiophen-2-yl)acrylate
Acta Crystallographica Section E, 2019, 75, 1357-1361
2243069 CIF
HKL
Paper
C27 H26 O SiP 1 21/c 111.8576; 13.2995; 14.3948
90; 110.363; 90
2128.2Williams, Alexandra; Brown, Michelle; Staples, Richard J.; Biros, Shannon M.; Winchester, William R.
Syntheses and crystal structures of 2-methyl-1,1,2,3,3-pentaphenyl-2-silapropane and 2-methyl-1,1,3,3-tetraphenyl-2-silapropan-2-ol
Acta Crystallographica Section E, 2019, 75, 1339-1343
2243070 CIF
HKL
C33 H30 SiP -110.3879; 10.5037; 13.635
68.8212; 70.6364; 84.7947
1308.06Williams, Alexandra; Brown, Michelle; Staples, Richard J.; Biros, Shannon M.; Winchester, William R.
Syntheses and crystal structures of 2-methyl-1,1,2,3,3-pentaphenyl-2-silapropane and 2-methyl-1,1,3,3-tetraphenyl-2-silapropan-2-ol
Acta Crystallographica Section E, 2019, 75, 1339-1343
2243071 CIF
HKL
Paper
C15 H9 Br Cl2 OP 1 21/c 13.9834; 13.471; 25.661
90; 92.736; 90
1375.4Bindya, S.; Chidan Kumar, C. S.; Naveen, S.; Siddaraju, B. P.; Quah, Ching Kheng; Md. Abu Raihan
Crystal structure and Hirshfeld surface analysis of a bromochalcone: (<i>E</i>)-1-(3-bromophenyl)-3-(2,6-dichlorophenyl)prop-2-en-1-one
Acta Crystallographica, Section E, 2019, 75, 264-267
2243072 CIF
HKL
Paper
C12 H15 N3 O2 SP n a 2111.7579; 15.0584; 7.1103
90; 90; 90
1258.92Tran Buu, Dang; Duong Ba, Vu; Khoi Nguyen Hoang, Minh; Vu Quoc, Trung; Duong Khanh, Linh; Oanh Doan Thi, Yen; Van Meervelt, Luc
Synthesis and redetermination of the crystal structure of salicylaldehyde <i>N</i>(4)-morpholinothiosemicarbazone
Acta Crystallographica Section E, 2019, 75, 1389-1393
2243073 CIF
HKL
C22 H30 Ag F6 N6 P S2P 1 21/c 113.827; 26.243; 8.1218
90; 95.678; 90
2932.6Groner, Vincent M.; Larson, Garrett E.; Kan, Yuwei; Roll, Mark F.; Moberly, James G.; Waynant, Kristopher V.
The synthesis and crystal structure of bis[3,3-diethyl-1-(phenylimino-κ<i>N</i>)thiourea-κ<i>S</i>]silver hexafluoridophosphate
Acta Crystallographica Section E, 2019, 75, 1394-1398
2243074 CIF
Paper
C17 H19 I O3P 1 21/c 19.4977; 9.3635; 19.8978
90; 102.752; 90
1725.9Yin, Dejing
Synthesis and crystal structure of <i>tert</i>-butyl 1-(2-iodobenzoyl)cyclopent-3-ene-1-carboxylate
Acta Crystallographica Section E, 2019, 75, 1383-1385
2243075 CIF
HKL
Paper
C14 H15 Br Cl N O4P 1 21/c 112.4682; 14.6397; 8.3524
90; 91.392; 90
1524.12Abdellaoui, Omar; Hökelek, Tuncer; Capet, Frédéric; Renard, Catherine; Haoudi, Amal; Skalli, Mohamed Khalid; Kandri Rodi, Youssef
Crystal structure, Hirshfeld surface analysis and DFT studies of 5-bromo-1-{2-[2-(2-chloroethoxy)ethoxy]ethyl}indoline-2,3-dione
Acta Crystallographica Section E, 2019, 75, 1372-1378
2243076 CIF
HKL
Paper
C19 H20 O5P -16.8072; 8.5792; 15.801
100.365; 99.433; 104.984
855.09Jumaah, Maadh; Kwong, Huey Chong; Khairuddean, Melati
Crystal structure of (<i>E</i>)-3-(2-hydroxy-4-methylphenyl)-1-(2,4,6-trimethoxyphenyl)prop-2-en-1-one
Acta Crystallographica Section E, 2019, 75, 1379-1382
2243077 CIF
HKL
Paper
Cl2 H6 N2 ZnI m m a7.7077; 8.0226; 8.4526
90; 90; 90
522.67Ivšić, Trpimir; Bi, David Wenhua; Magrez, Arnaud
New refinement of the crystal structure of Zn(NH~3~)~2~Cl~2~ at 100K
Acta Crystallographica Section E, 2019, 75, 1386-1388
2243078 CIF
HKL
Paper
C21 H21 N2 O6.5 S0.5C 1 2/c 133.0258; 5.4412; 22.4342
90; 107.203; 90
3851.07Gomes, Ligia R.; Low, John Nicolson; Wardell, James L.; Capelini, Camiola; Câmara, Vitoria R.F.; da Silva, Edson F.; Carvalho, Samir A.
Crystal structures and Hirshfeld surface analyses of (<i>E</i>)-<i>N</i>'-benzylidene-2-oxo-2<i>H</i>-chromene-3-carbohydrazide and the disordered hemi-DMSO solvate of (<i>E</i>)-2-oxo-<i>N</i>'-(3,4,5-trimethoxybenzylidene)-2<i>H</i>-chromene-3-carbohydrazide: lattice energy and intermolecular interaction energy calculations for the former
Acta Crystallographica Section E, 2019, 75, 1403-1410
2243079 CIF
HKL
Paper
C17 H12 N2 O3P -15.6715; 7.4164; 15.9819
88.369; 84.147; 82.961
663.6Gomes, Ligia R.; Low, John Nicolson; Wardell, James L.; Capelini, Camiola; Câmara, Vitoria R.F.; da Silva, Edson F.; Carvalho, Samir A.
Crystal structures and Hirshfeld surface analyses of (<i>E</i>)-<i>N</i>'-benzylidene-2-oxo-2<i>H</i>-chromene-3-carbohydrazide and the disordered hemi-DMSO solvate of (<i>E</i>)-2-oxo-<i>N</i>'-(3,4,5-trimethoxybenzylidene)-2<i>H</i>-chromene-3-carbohydrazide: lattice energy and intermolecular interaction energy calculations for the former
Acta Crystallographica Section E, 2019, 75, 1403-1410
2243080 CIF
HKL
Paper
C15 H12 Cl N O3P 1 21/n 17.1809; 21.4466; 8.9173
90; 92.784; 90
1371.7Hayani, Sonia; Filali Baba, Yassir; Hökelek, Tuncer; Ouazzani Chahdi, Fouad; Mague, Joel T.; Sebbar, Nada Kheira; Kandri Rodi, Youssef
Crystal structure, Hirshfeld surface analysis and interaction energy and DFT studies of 2-chloroethyl 2-oxo-1-(prop-2-yn-1-yl)-1,2-dihydroquinoline-4-carboxylate
Acta Crystallographica Section E, 2019, 75, 1411-1417
2243081 CIF
HKL
Paper
C20 H19 N3 O4 SP -16.7559; 16.9258; 19.0611
110.447; 96.854; 93.37
2015.84NizamMohideen, M.; Syed Abuthahir, S.; Viswanathan, V.; Velmurugan, D.; Karthik Ananth, M.
The crystal structures and Hirshfeld surface analyses of four 3,5-diacetyl-2-methyl-2,3-dihydro-1,3,4-thiadiazol-2-yl derivatives
Acta Crystallographica Section E, 2019, 75, 1436-1444
2243082 CIF
Paper
C17 H21.5 N3 O4.25 SP -16.7802; 17.2671; 17.3089
108.224; 99.084; 96.72
1870.5NizamMohideen, M.; Syed Abuthahir, S.; Viswanathan, V.; Velmurugan, D.; Karthik Ananth, M.
The crystal structures and Hirshfeld surface analyses of four 3,5-diacetyl-2-methyl-2,3-dihydro-1,3,4-thiadiazol-2-yl derivatives
Acta Crystallographica Section E, 2019, 75, 1436-1444
2243083 CIF
HKL
Paper
C16 H19 N3 O4 SP -111.415; 12.4021; 13.2305
71.982; 89.829; 83.114
1767.18NizamMohideen, M.; Syed Abuthahir, S.; Viswanathan, V.; Velmurugan, D.; Karthik Ananth, M.
The crystal structures and Hirshfeld surface analyses of four 3,5-diacetyl-2-methyl-2,3-dihydro-1,3,4-thiadiazol-2-yl derivatives
Acta Crystallographica Section E, 2019, 75, 1436-1444
2243084 CIF
HKL
Paper
C22.5 H21.5 Cl1.5 N3 O4 SP -110.7427; 11.0828; 20.8969
93.186; 103.945; 98.489
2377.4NizamMohideen, M.; Syed Abuthahir, S.; Viswanathan, V.; Velmurugan, D.; Karthik Ananth, M.
The crystal structures and Hirshfeld surface analyses of four 3,5-diacetyl-2-methyl-2,3-dihydro-1,3,4-thiadiazol-2-yl derivatives
Acta Crystallographica Section E, 2019, 75, 1436-1444
2243085 CIF
HKL
C25 H12 Cl6 O4P 1 21/c 117.9667; 7.915; 17.6995
90; 110.673; 90
2354.92Muto, Toyokazu; Iida, Kikuko; Noguchi, Keiichi; Yonezawa, Noriyuki; Okamoto, Akiko
Crystal structure and Hirshfeld surface analysis of 2-hydroxy-7-methoxy-1,8-bis(2,4,6-trichlorobenzoyl)naphthalene
Acta Crystallographica Section E, 2019, 75, 1418-1422
2243086 CIF
HKL
Paper
C16 H17 Cl4 N O3C 1 c 126.406; 9.5558; 7.1019
90; 101.076; 90
1758.6Uprety, Bhawna; Arderne, Charmaine
The crystal structure of the zwitterionic co-crystal of 2,4-dichloro-6-{[(3-hydroxypropyl)ammonio]methyl}phenolate and 2,4-dichlorophenol
Acta Crystallographica Section E, 2019, 75, 1452-1455
2243087 CIF
HKL
Paper
C27 H29 Br N2P 1 21/c 19.9949; 23.546; 10.2919
90; 108.334; 90
2299.1Kubono, Koji; Matsumoto, Taisuke; Taneda, Masatsugu
Crystal structure of 4-bromo-<i>N</i>-[(3,6-di-<i>tert</i>-butyl-9<i>H</i>-carbazol-1-yl)methylidene]aniline
Acta Crystallographica Section E, 2019, 75, 1429-1431
2243088 CIF
HKL
Paper
C17 H33 N3 O5 SP c a 2117.5093; 7.8052; 30.3155
90; 90; 90
4143Wickramasinhage, Ravindra N.; McAdam, C. John; Hanton, Lyall R.; Moratti, Stephen C.; Simpson, Jim
The structure and Hirshfeld surface analysis of the salt 3-methacrylamido-<i>N</i>,<i>N</i>,<i>N</i>-trimethylpropan-1-aminium 2-acrylamido-2-methylpropane-1-sulfonate
Acta Crystallographica Section E, 2019, 75, 1445-1451
2243089 CIF
HKL
Paper
C14 H10 Cl2 N2 OP 1 21/n 18.5614; 15.6055; 10.0527
90; 95.031; 90
1337.9Manawar, Rohit B.; Gondaliya, Mitesh B.; Shah, Manish K.; Jotani, Mukesh M.; Tiekink, Edward R. T.
2-{(1<i>E</i>)-[(<i>E</i>)-2-(2,6-Dichlorobenzylidene)hydrazin-1-ylidene]methyl}phenol: crystal structure, Hirshfeld surface analysis and computational study
Acta Crystallographica Section E, 2019, 75, 1423-1428
2243090 CIF
HKL
Paper
C13 H18 N2 O3 SP 1 21/c 17.4051; 10.6213; 18.569
90; 94.117; 90
1456.7Tan, Sang Loon; Azizan, Ainnul Hamidah Syahadah; Jotani, Mukesh M.; Tiekink, Edward R. T.
3,3-Bis(2-hydroxyethyl)-1-[(4-methylphenyl)carbonyl]thiourea: crystal structure, Hirshfeld surface analysis and computational study
Acta Crystallographica Section E, 2019, 75, 1472-1478
2243091 CIF
HKL
Paper
C25 H29 N S2 SnP -19.7572; 11.703; 11.7602
74.419; 80.114; 67.285
1189.7Haezam, Farah Natasha; Awang, Normah; Kamaludin, Nurul Farahana; Jotani, Mukesh M.; Tiekink, Edward R. T.
(<i>N</i>,<i>N</i>'-Diisopropyldithiocarbamato)triphenyltin(IV): crystal structure, Hirshfeld surface analysis and computational study
Acta Crystallographica Section E, 2019, 75, 1479-1485
2243092 CIF
HKL
Paper
C34 H28 Cl2 N2 O2P 1 21/c 18.671; 15.6756; 20.2284
90; 93.036; 90
2745.6Sribala, R.; Indhumathi, S.; Krishnakumar, R.V.; Srinivasan, N.
Crystal structure and molecular Hirshfeld surface analysis of acenaphthene derivatives obeying the chlorine‒methyl exchange rule
Acta Crystallographica Section E, 2019, 75, 1456-1462
2243093 CIF
HKL
Paper
C36 H34 N2 O2P 1 21/c 18.7507; 15.9089; 20.2879
90; 92.935; 90
2820.7Sribala, R.; Indhumathi, S.; Krishnakumar, R.V.; Srinivasan, N.
Crystal structure and molecular Hirshfeld surface analysis of acenaphthene derivatives obeying the chlorine‒methyl exchange rule
Acta Crystallographica Section E, 2019, 75, 1456-1462
2243094 CIF
HKL
C24 H31 N3 O2P -16.095; 10.215; 17.995
84.781; 85.688; 76.012
1081Asgarova, Ayten R.
Crystal structure and Hirshfeld surface analysis of 5-(3,5-di-<i>tert</i>-butyl-4-hydroxyphenyl)-3-phenyl-4,5-dihydro-1<i>H</i>-pyrazole-1-carboxamide
Acta Crystallographica Section E, 2019, 75, 1467-1471
2243095 CIF
HKL
C24 H22 N4 O4P 1 21/c 17.9556; 14.8583; 17.3362
90; 95.556; 90
2039.6Moon, Suk-Hee; Kim, Jinho; Park, Ki-Min; Kang, Youngjin
Crystal structure and Hirshfeld surface analysis of 2,2''',6,6'''-tetramethoxy-3,2':5',3'':6'',3'''-quaterpyridine
Acta Crystallographica Section E, 2019, 75, 1511-1514
2243096 CIF
HKL
Paper
C18 H18 F2 N2 O3P 21 21 2113.4775; 28.026; 9.1085
90; 90; 90
3440.5Artheswari, G.; Maheshwaran, V.; Gautham, N.
Crystal structure and Hirshfeld surface analysis of 3-(cyclopropylmethoxy)-4-(difluoromethoxy)-<i>N</i>-(pyridin-2-ylmethyl)benzamide
Acta Crystallographica Section E, 2019, 75, 1515-1518
2243097 CIF
HKL
Paper
C18 H24 N2 O4P -16.215; 7.547; 18.716
84.34; 87.14; 84.69
869.1Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Glidewell, Christopher
Twelve 4-(4-methoxyphenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in one, two and three dimensions
Acta Crystallographica Section E, 2019, 75, 1494-1506
2243098 CIF
HKL
Paper
C18 H23 F N2 O4P -16.256; 7.489; 19.097
84.19; 86.98; 84.62
885.4Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Glidewell, Christopher
Twelve 4-(4-methoxyphenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in one, two and three dimensions
Acta Crystallographica Section E, 2019, 75, 1494-1506
2243099 CIF
HKL
Paper
C18 H23 Cl N2 O4P -16.211; 7.481; 20.144
84.9; 87.48; 85.19
928.4Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Glidewell, Christopher
Twelve 4-(4-methoxyphenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in one, two and three dimensions
Acta Crystallographica Section E, 2019, 75, 1494-1506
2243100 CIF
HKL
Paper
C18 H23 Br N2 O4P -16.2004; 7.4957; 20.44
85.08; 87.37; 85
942.17Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Glidewell, Christopher
Twelve 4-(4-methoxyphenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in one, two and three dimensions
Acta Crystallographica Section E, 2019, 75, 1494-1506
2243101 CIF
HKL
Paper
C18 H22 N2 O4P 21 21 216.5009; 7.9735; 32.155
90; 90; 90
1666.8Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Glidewell, Christopher
Twelve 4-(4-methoxyphenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in one, two and three dimensions
Acta Crystallographica Section E, 2019, 75, 1494-1506
2243102 CIF
HKL
Paper
C17 H21 N3 O3P b c a9.2817; 11.2905; 30.309
90; 90; 90
3176.2Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Glidewell, Christopher
Twelve 4-(4-methoxyphenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in one, two and three dimensions
Acta Crystallographica Section E, 2019, 75, 1494-1506
2243103 CIF
HKL
Paper
C18 H20 N4 O8P 1 21/c 17.55; 7.6489; 32.719
90; 91.3; 90
1889Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Glidewell, Christopher
Twelve 4-(4-methoxyphenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in one, two and three dimensions
Acta Crystallographica Section E, 2019, 75, 1494-1506
2243104 CIF
HKL
Paper
C15 H22 N2 O5P n a 219.3225; 28.261; 5.8228
90; 90; 90
1534.1Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Glidewell, Christopher
Twelve 4-(4-methoxyphenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in one, two and three dimensions
Acta Crystallographica Section E, 2019, 75, 1494-1506
2243105 CIF
HKL
Paper
C15 H20 N2 O5P n a 219.069; 28.528; 5.8375
90; 90; 90
1510.3Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Glidewell, Christopher
Twelve 4-(4-methoxyphenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in one, two and three dimensions
Acta Crystallographica Section E, 2019, 75, 1494-1506
2243106 CIF
HKL
Paper
C15 H20 N2 O5P 1 21/c 19.063; 6.4956; 26.093
90; 93.18; 90
1533.7Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Glidewell, Christopher
Twelve 4-(4-methoxyphenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in one, two and three dimensions
Acta Crystallographica Section E, 2019, 75, 1494-1506
2243107 CIF
HKL
Paper
C13 H17 Cl3 N2 O3P c a 2110.6117; 13.808; 10.9137
90; 90; 90
1599.1Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Glidewell, Christopher
Twelve 4-(4-methoxyphenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in one, two and three dimensions
Acta Crystallographica Section E, 2019, 75, 1494-1506
2243108 CIF
HKL
Paper
C14 H19 Cl N2 O4P 1 21/n 19.1597; 15.1434; 10.8742
90; 102.067; 90
1475.02Kiran Kumar, Haruvegowda; Yathirajan, Hemmige S.; Foro, Sabine; Glidewell, Christopher
Twelve 4-(4-methoxyphenyl)piperazin-1-ium salts containing organic anions: supramolecular assembly in one, two and three dimensions
Acta Crystallographica Section E, 2019, 75, 1494-1506
2243109 CIF
Paper
C10 H16 Fe N4 O4 PtP 4/m m m7.4802; 7.4802; 7.9725
90; 90; 90
446.09Kuzevanova, Iryna S.; Naumova, Dina D.; Terebilenko, Kateryna V.; Shova, Sergiu; Gural'skiy, Il'ya A.
Crystal structure of poly[[diaquatetra-μ~2~-cyanido-iron(II)platinum(II)] acetone disolvate]
Acta Crystallographica Section E, 2019, 75, 1536-1539
2243110 CIF
HKL
Paper
C20 H17 Cl2 N2 O4P 1 21/c 112.753; 6.665; 24.05
90; 102.95; 90
1992Silambarasan, S.; Nasser, A. Jamal Abdul; Mohandas, T.
Crystal structures of two 4<i>H</i>-chromene derivatives: 2-amino-3-cyano-4-(3,4-dichlorophenyl)-7-hydroxy-4<i>H</i>-benzo[1,2-<i>b</i>]pyran 1,4-dioxane monosolvate and 2-amino-3-cyano-4-(2,6-dichlorophenyl)-7-hydroxy-4<i>H</i>-benzo[1,2-<i>b</i>]pyran
Acta Crystallographica Section E, 2019, 75, 1568-1572
2243111 CIF
HKL
Paper
C16 H9 Cl2 N2 O2P -16.271; 8.697; 13.794
107.06; 94.269; 95
712.5Silambarasan, S.; Nasser, A. Jamal Abdul; Mohandas, T.
Crystal structures of two 4<i>H</i>-chromene derivatives: 2-amino-3-cyano-4-(3,4-dichlorophenyl)-7-hydroxy-4<i>H</i>-benzo[1,2-<i>b</i>]pyran 1,4-dioxane monosolvate and 2-amino-3-cyano-4-(2,6-dichlorophenyl)-7-hydroxy-4<i>H</i>-benzo[1,2-<i>b</i>]pyran
Acta Crystallographica Section E, 2019, 75, 1568-1572
2243112 CIF
HKL
Paper
C64 H33 F10 N5 Ni S2P 21 21 2112.6269; 18.0525; 24.9524
90; 90; 90
5687.83Gutzeit, Florian; Neumann, Tjorge; Näther, Christian; Herges, Rainer
Crystal structure of (15,20-bis(2,3,4,5,6-pentafluorophenyl)-5,10-{(4-methylpyridine-3,5-diyl)bis[(sulfanediylmethylene)[1,1'-biphenyl]-4',2-diyl]}porphyrinato)nickel(II) dichloromethane <i>x</i>-solvate (<i>x</i> > 1/2)
Acta Crystallographica Section E, 2019, 75, 1558-1563
2243113 CIF
HKL
Paper
C16 H14 N2 O3 SP 1 21/c 113.667; 6.8704; 16.722
90; 108.02; 90
1493.1Aydin, Abdullah; Celikesir, Sevim Turktekin; Akkurt, Mehmet; Saylam, Merve; Pabuccuoglu, Varol
Crystal structure and Hirshfeld surface analysis of 2-[(1,3-benzoxazol-2-yl)sulfanyl]-<i>N</i>-(2-methoxyphenyl)acetamide
Acta Crystallographica Section E, 2019, 75, 1531-1535
2243114 CIF
HKL
Paper
C16 H10 Cl N3 O6C 1 2/c 120.5876; 7.6889; 20.4312
90; 104.534; 90
3130.68Gotoh, Kazuma; Ishida, Hiroyuki
Crystal structures of 3-chloro-2-nitrobenzoic acid with quinoline derivatives: 3-chloro-2-nitrobenzoic acid‒5-nitroquinoline (1/1), 3-chloro-2-nitrobenzoic acid‒6-nitroquinoline (1/1) and 8-hydroxyquinolinium 3-chloro-2-nitrobenzoate
Acta Crystallographica Section E, 2019, 75, 1552-1557
2243115 CIF
HKL
Paper
C16 H10 Cl N3 O6P -17.7282; 10.2839; 11.2828
71.99; 79.724; 69.051
794.08Gotoh, Kazuma; Ishida, Hiroyuki
Crystal structures of 3-chloro-2-nitrobenzoic acid with quinoline derivatives: 3-chloro-2-nitrobenzoic acid‒5-nitroquinoline (1/1), 3-chloro-2-nitrobenzoic acid‒6-nitroquinoline (1/1) and 8-hydroxyquinolinium 3-chloro-2-nitrobenzoate
Acta Crystallographica Section E, 2019, 75, 1552-1557
2243116 CIF
HKL
Paper
C16 H11 Cl N2 O5P 1 21/n 17.3409; 7.4689; 27.0427
90; 95.7158; 90
1475.34Gotoh, Kazuma; Ishida, Hiroyuki
Crystal structures of 3-chloro-2-nitrobenzoic acid with quinoline derivatives: 3-chloro-2-nitrobenzoic acid‒5-nitroquinoline (1/1), 3-chloro-2-nitrobenzoic acid‒6-nitroquinoline (1/1) and 8-hydroxyquinolinium 3-chloro-2-nitrobenzoate
Acta Crystallographica Section E, 2019, 75, 1552-1557
2243117 CIF
HKL
Paper
C37 H26 N4 O3 SP 1 21/n 18.369; 13.244; 29.221
90; 93.28; 90
3233.52Foize Ahmad, G.; Syed Mohammed Mujaheer, A.; NizamMohideen, M.; Gulam Mohamed, M.; Viswanathan, V.
The crystal structures and Hirshfeld surface analysis of 6-(naphthalen-1-yl)-6a-nitro-6,6a,6b,7,9,11a-hexahydrospiro[chromeno[3',4':3,4]pyrrolo[1,2-<i>c</i>]thiazole-11,11'-indeno[1,2-<i>b</i>]quinoxaline] and 6'-(naphthalen-1-yl)-6a'-nitro-6',6a',6b',7',8',9',10',12a'-octahydro-2<i>H</i>-spiro[acenaphthylene-1,12'-chromeno[3,4-<i>a</i>]indolizin]-2-one
Acta Crystallographica Section E, 2019, 75, 1519-1524
2243118 CIF
HKL
Paper
C36 H28 N2 O4C 1 2/c 135.736; 11.451; 15.313
90; 98.378; 90
6199.4Foize Ahmad, G.; Syed Mohammed Mujaheer, A.; NizamMohideen, M.; Gulam Mohamed, M.; Viswanathan, V.
The crystal structures and Hirshfeld surface analysis of 6-(naphthalen-1-yl)-6a-nitro-6,6a,6b,7,9,11a-hexahydrospiro[chromeno[3',4':3,4]pyrrolo[1,2-<i>c</i>]thiazole-11,11'-indeno[1,2-<i>b</i>]quinoxaline] and 6'-(naphthalen-1-yl)-6a'-nitro-6',6a',6b',7',8',9',10',12a'-octahydro-2<i>H</i>-spiro[acenaphthylene-1,12'-chromeno[3,4-<i>a</i>]indolizin]-2-one
Acta Crystallographica Section E, 2019, 75, 1519-1524
2243119 CIF
HKL
Paper
C18 H32 F6 Fe O10 S2P 21 21 218.6618; 16.261; 19.0572
90; 90; 90
2684.2Riemersma, Charl F.; Monkcom, Emily C.; Klein Gebbink, Robertus J. M.; Lutz, Martin
Crystal structure of tetrakis(tetrahydrofuran-κ<i>O</i>)bis(trifluoromethanesulfonato-κ<i>O</i>)iron(II)
Acta Crystallographica Section E, 2019, 75, 1548-1551
2243120 CIF
HKL
Paper
C9 H12 Br N3 SP 1 21/n 110.5986; 8.7168; 13.0308
90; 111.513; 90
1119.99Duruskari, Gulnara Sh.; Khalilov, Ali N.; Akkurt, Mehmet; Mammadova, Gunay Z.; Chyrka, Taras; Maharramov, Abel M.
Crystal structure and Hirshfeld surface analysis of 3-amino-5-phenylthiazolidin-2-iminium bromide
Acta Crystallographica Section E, 2019, 75, 1544-1547
2243121 CIF
HKL
Paper
C36 F30 N3 O6 P3P 1 21/c 18.1111; 44.054; 12.259
90; 109.612; 90
4126.3Yennawar, Hemant P.; Hess, Andrew R.; Allcock, Harry R.
Crystal structures of three hexakis(fluoroaryloxy)cyclotriphosphazenes
Acta Crystallographica Section E, 2019, 75, 1525-1530
2243122 CIF
HKL
C42 H24 F18 N3 O6 P3P -113.4906; 13.6573; 14.9377
65.253; 68.874; 71.715
2288Yennawar, Hemant P.; Hess, Andrew R.; Allcock, Harry R.
Crystal structures of three hexakis(fluoroaryloxy)cyclotriphosphazenes
Acta Crystallographica Section E, 2019, 75, 1525-1530
2243123 CIF
HKL
C48 H18 F36 N3 O6 P3P -18.9782; 13.947; 23.205
97.276; 93.155; 91.615
2876.1Yennawar, Hemant P.; Hess, Andrew R.; Allcock, Harry R.
Crystal structures of three hexakis(fluoroaryloxy)cyclotriphosphazenes
Acta Crystallographica Section E, 2019, 75, 1525-1530
2243124 CIF
HKL
Paper
C19 H19 N3P c a 219.3492; 16.3716; 10.803
90; 90; 90
1653.52Tber, Zahira; Kansiz, Sevgi; El Hafi, Mohamed; Loubidi, Mohamed; Jouha, Jabrane; Dege, Necmi; Essassi, El Mokhtar; Mague, Joel T.
Crystal structure and Hirshfeld surface analysis of <i>N</i>-(<i>tert</i>-butyl)-2-(phenylethynyl)imidazo[1,2-<i>a</i>]pyridin-3-amine
Acta Crystallographica Section E, 2019, 75, 1564-1567
2243125 CIF
HKL
Paper
C21 H41 N3 O5P 1 21/c 110.0905; 14.8664; 16.1261
90; 97.347; 90
2399.2Ara, Irene; Basdouri, Zeineb; Falvello, Larry R.; Graia, Mohsen; Guerra, Pablo; Tomás, Milagros
Tetra-<i>n</i>-butylammonium orotate monohydrate: knowledge-based comparison of the results of accurate and lower-resolution analyses and a non-routine disorder refinement
Acta Crystallographica Section E, 2019, 75, 1632-1637
2243126 CIF
HKL
Paper
C21 H41 N3 O5P 1 21/c 110.1335; 14.669; 16.9205
90; 96.63; 90
2498.4Ara, Irene; Basdouri, Zeineb; Falvello, Larry R.; Graia, Mohsen; Guerra, Pablo; Tomás, Milagros
Tetra-<i>n</i>-butylammonium orotate monohydrate: knowledge-based comparison of the results of accurate and lower-resolution analyses and a non-routine disorder refinement
Acta Crystallographica Section E, 2019, 75, 1632-1637
2243127 CIF
HKL
Paper
C16 H18 N2 O4P b c a12.1452; 8.1784; 31.2738
90; 90; 90
3106.4Duong Khanh, Linh; Hanh Trinh Thi, My; Quynh Bui Thi, Thuy; Vu Quoc, Trung; Nguyen Thien, Vuong; Van Meervelt, Luc
Synthesis, crystal structure and Hirshfeld surface analysis of 4-[3-(4-hydroxyphenyl)-4,5-dihydro-1<i>H</i>-pyrazol-5-yl]-2-methoxyphenol monohydrate
Acta Crystallographica Section E, 2019, 75, 1590-1594
2243128 CIF
HKL
Paper
C14 H22 Cl6 Hg2 N4P -17.6558; 11.8961; 13.5853
82.95; 76.072; 76.339
1164.07Garci, Fatma; Ferjani, Hela; Chebbi, Hammouda; Ben Jomaa, Mariem; Zid, Mohamed Faouzi
Crystal structure, Hirshfeld surface analysis and physicochemical characterization of bis[4-(dimethylamino)pyridinium] di-μ-chlorido-bis[dichloridomercurate(II)]
Acta Crystallographica Section E, 2019, 75, 1600-1606
2243129 CIF
HKL
Paper
C27 H26 N2 O2 S2P -110.201; 20.026; 25.2349
70.535; 86.852; 82.147
4814.65Arif Tawfeeq, Nabeel; Kwong, Huey Chong; Mohamed Tahir, Mohamed Ibrahim; Ravoof, Thahira B. S. A.
Crystal structure of benzyl <i>N</i>'-[(1<i>E</i>,4<i>E</i>)-1,5-bis(4-methoxyphenyl)penta-1,4-dien-3-ylidene]hydrazine-1-carbodithioate
Acta Crystallographica Section E, 2019, 75, 1613-1619
2243130 CIF
HKL
Paper
C13 H8 Br2 N2P b c a14.1711; 6.0546; 27.7102
90; 90; 90
2377.54Khamees, Hussien Ahmed; Chaluvaiah, Kumara; El-khatatneh, Nasseem Ahmed; Swamynayaka, Ananda; Chong, Kwong Huey; Dasappa, Jagadeesh Prasad; Madegowda, Mahendra
Crystal structure, DFT calculation, Hirshfeld surface analysis and energy framework study of 6-bromo-2-(4-bromophenyl)imidazo[1,2-<i>a</i>]pyridine
Acta Crystallographica Section E, 2019, 75, 1620-1626
2243131 CIF
HKL
Paper
C2 H10 O8 S2P 1 21/n 15.805; 8.3566; 8.7433
90; 95.148; 90
422.43Mazurek, Jaroslaw; Fernandez-Casares, Ana
The crystal structures of two novel polymorphs of bis(oxonium) ethane-1,2-disulfonate
Acta Crystallographica Section E, 2019, 75, 1586-1589
2243132 CIF
HKL
C2 H10 O8 S2P -15.0371; 5.5424; 8.8188
98.426; 104.511; 91.663
235.22Mazurek, Jaroslaw; Fernandez-Casares, Ana
The crystal structures of two novel polymorphs of bis(oxonium) ethane-1,2-disulfonate
Acta Crystallographica Section E, 2019, 75, 1586-1589
2243133 CIF
HKL
Paper
C5 H5 Ga N2 O6P -16.6055; 6.883; 8.5178
94.804; 101.306; 108.596
355.44Simões, Andrea B.; Figueira, Flávio; Mendes, Ricardo F.; Barbosa, Jéssica S.; Rocha, João; Paz, Filipe A. Almeida
One-dimensional ladder gallium coordination polymer
Acta Crystallographica Section E, 2019, 75, 1607-1612
2243134 CIF
HKL
C18 H15 N O2P 1 21/c 19.2298; 9.0302; 16.7375
90; 97.863; 90
1381.9Bogdanov, Georgii; Tillotson, John P.; Timofeeva, Tatiana
Crystal structures, syntheses, and spectroscopic and electrochemical measurements of two push‒pull chromophores: 2-[4-(dimethylamino)benzylidene]-1<i>H</i>-indene-1,3(2<i>H</i>)-dione and (<i>E</i>)-2-{3-[4-(dimethylamino)phenyl]allylidene}-1<i>H</i>-indene-1,3(2<i>H</i>)-dione
Acta Crystallographica Section E, 2019, 75, 1595-1599
2243135 CIF
HKL
C20 H17 N O2P 1 21 111.072; 3.9664; 17.557
90; 104.5; 90
746.5Bogdanov, Georgii; Tillotson, John P.; Timofeeva, Tatiana
Crystal structures, syntheses, and spectroscopic and electrochemical measurements of two push‒pull chromophores: 2-[4-(dimethylamino)benzylidene]-1<i>H</i>-indene-1,3(2<i>H</i>)-dione and (<i>E</i>)-2-{3-[4-(dimethylamino)phenyl]allylidene}-1<i>H</i>-indene-1,3(2<i>H</i>)-dione
Acta Crystallographica Section E, 2019, 75, 1595-1599
2243136 CIF
HKL
Paper
C15.5 H33 N2 O4.5 S4 ZnP 1 21/n 19.604; 22.785; 11.374
90; 106.304; 90
2388.8Qadir, Adnan M.; Kansiz, Sevgi; Dege, Necmi; Rosair, Georgina M.; Fritsky, Igor O.
Crystal structure and DFT study of a zinc xanthate complex
Acta Crystallographica Section E, 2019, 75, 1582-1585
2243137 CIF
HKL
C13 H12 N2 O4P 1 21 15.1593; 8.6124; 13.5745
90; 97.087; 90
598.56Siva, V.; Suresh, M.; Athimoolam, S.; Asath Bahadur, S.
Crystal structure and Hirshfeld surface analysis of 2-aminopyridinium hydrogen phthalate
Acta Crystallographica Section E, 2019, 75, 1627-1631
2243138 CIF
HKL
Paper
C13 H30 Cl3 Cu N5 O14P n a 2118.99; 9.364; 13.636
90; 90; 90
2424.8Tsymbal, Liudmyla V.; Arion, Vladimir B.; Lampeka, Yaroslaw D.
The first structural characterization of the protonated azacyclam ligand in <i>catena</i>-poly[[[(perchlorato)copper(II)]-μ-3-(3-carboxypropyl)-1,5,8,12-tetraaza-3-azoniacyclotetradecane] bis(perchlorate)]
Acta Crystallographica Section E, 2019, 75, 1700-1704
2243139 CIF
HKL
C29 H22 N4 O3I 1 a 19.6979; 23.6702; 9.9229
90; 92.9125; 90
2274.87Moon, Suk-Hee; Park, Ki-Min; Kim, Jinho; Kang, Youngjin
Crystal structure and luminescence properties of 2-[(2',6'-dimethoxy-2,3'-bipyridin-6-yl)oxy]-9-(pyridin-2-yl)-9<i>H</i>-carbazole
Acta Crystallographica Section E, 2019, 75, 1646-1649
2243140 CIF
HKL
Paper
C24 H44 Cl14 Mo6 N6 O4P -19.9813; 10.6074; 12.1686
104.606; 90.709; 103.146
1210.7Johnston, Dean H.; Agho, Ikponmwosa
Crystal structures and hydrogen-bonding analysis of a series of solvated ammonium salts of molybdenum(II) chloride clusters
Acta Crystallographica Section E, 2019, 75, 1705-1711
2243141 CIF
HKL
Paper
C24 H52 Cl14 Mo6 N8 O6P -110.1752; 10.3227; 13.736
95.204; 111.483; 101.973
1291.1Johnston, Dean H.; Agho, Ikponmwosa
Crystal structures and hydrogen-bonding analysis of a series of solvated ammonium salts of molybdenum(II) chloride clusters
Acta Crystallographica Section E, 2019, 75, 1705-1711
2243142 CIF
HKL
Paper
C21 H36 Cl14 Mo6 N2 O3P -19.451; 11.236; 11.712
64.933; 71.174; 75.44
1056.7Johnston, Dean H.; Agho, Ikponmwosa
Crystal structures and hydrogen-bonding analysis of a series of solvated ammonium salts of molybdenum(II) chloride clusters
Acta Crystallographica Section E, 2019, 75, 1705-1711
2243143 CIF
HKL
Paper
C24 H42 Cl14 Mo6 N6 O4P -19.8252; 10.0933; 12.6319
107.395; 91.881; 93.309
1191.8Johnston, Dean H.; Agho, Ikponmwosa
Crystal structures and hydrogen-bonding analysis of a series of solvated ammonium salts of molybdenum(II) chloride clusters
Acta Crystallographica Section E, 2019, 75, 1705-1711
2243144 CIF
HKL
Paper
C127 H116 Ag3 N11 O2 S3P -114.86462; 19.3714; 19.85451
102.771; 100.827; 99.5778
5345.84Tacke, Matthias; Marhöfer, Daniel; Althani, Hessah; Müller-Bunz, Helge
Unexpected reactions of NHC*—Cu^I^ and —Ag^I^ bromides with potassium thio- or selenocyanate
Acta Crystallographica Section E, 2019, 75, 1657-1663
2243145 CIF
HKL
Paper
C122 H108 Ag2 Br2 Cl12 N8 Se4P -113.6265; 14.7422; 16.9397
106.417; 112.282; 96.2211
2930.05Tacke, Matthias; Marhöfer, Daniel; Althani, Hessah; Müller-Bunz, Helge
Unexpected reactions of NHC*—Cu^I^ and —Ag^I^ bromides with potassium thio- or selenocyanate
Acta Crystallographica Section E, 2019, 75, 1657-1663
2243146 CIF
HKL
Paper
C32 H27 Cu N4 SeP 1 21/c 113.7704; 14.3398; 28.4102
90; 93.024; 90
5602.2Tacke, Matthias; Marhöfer, Daniel; Althani, Hessah; Müller-Bunz, Helge
Unexpected reactions of NHC*—Cu^I^ and —Ag^I^ bromides with potassium thio- or selenocyanate
Acta Crystallographica Section E, 2019, 75, 1657-1663
2243147 CIF
HKL
Paper
C16 H10 Cl N3 O6P 1 21 112.8265; 4.7699; 13.5033
90; 109.713; 90
777.73Gotoh, Kazuma; Ishida, Hiroyuki
Crystal structures of the two isomeric hydrogen-bonded cocrystals 2-chloro-4-nitrobenzoic acid‒5-nitroquinoline (1/1) and 5-chloro-2-nitrobenzoic acid‒5-nitroquinoline (1/1)
Acta Crystallographica Section E, 2019, 75, 1694-1699
2243148 CIF
HKL
Paper
C16 H10 Cl N3 O6P -17.6682; 8.6515; 12.8609
79.17; 78.968; 70.394
781.8Gotoh, Kazuma; Ishida, Hiroyuki
Crystal structures of the two isomeric hydrogen-bonded cocrystals 2-chloro-4-nitrobenzoic acid‒5-nitroquinoline (1/1) and 5-chloro-2-nitrobenzoic acid‒5-nitroquinoline (1/1)
Acta Crystallographica Section E, 2019, 75, 1694-1699
2243149 CIF
HKL
Paper
C22 H16 N4 O2P -16.0464; 11.7175; 13.2931
95.735; 95.813; 101.78
910.16Filali, Mouad; El Ghayati, Lhoussaine; Hökelek, Tuncer; Mague, Joel T.; Ben-Tama, Abdessalam; El Hadrami, El Mestafa; Sebbar, Nada Kheira
Crystal structure, Hirshfeld surface analysis and interaction energy and DFT studies of methyl 4-[3,6-bis(pyridin-2-yl)pyridazin-4-yl]benzoate
Acta Crystallographica Section E, 2019, 75, 1672-1678
2243150 CIFC30 H20 Cl2 O2 SeP 14.9468; 5.8712; 21.353
85.019; 84.094; 86.465
613.68Bouraoui, Hazem; Mechehoud, Youcef; Chetioui, Souheyla; Touzani, Rachid; Medjani, Meriem; Benmilat, Ahmed; Boudjada, Ali
Crystal structure and Hirshfeld surface analysis of (2<i>E</i>,2'<i>E</i>)-1,1'-[selenobis(4,1-phenylene)]bis[3-(4-chlorophenyl)prop-2-en-1-one]
Acta Crystallographica Section E, 2019, 75, 1724-1728
2243151 CIF
HKL
Paper
C22 H15 Cl2 N O SP 1 21/c 19.0373; 16.6798; 12.511
90; 95.982; 90
1875.6Sebbar, Nada Kheira; Hni, Brahim; Hökelek, Tuncer; Labd Taha, Mohamed; Mague, Joel T.; El Ghayati, Lhoussaine; Essassi, El Mokhtar
Crystal structure, Hirshfeld surface analysis and interaction energy and DFT studies of (2<i>Z</i>)-4-benzyl-2-(2,4-dichlorobenzylidene)-2<i>H</i>-1,4-benzothiazin-3(4<i>H</i>)-one
Acta Crystallographica Section E, 2019, 75, 1650-1656
2243152 CIF
HKL
Paper
C13 H10 Cl N3 O5P 1 21/c 17.4897; 26.3607; 7.0623
90; 96.356; 90
1385.77Bairagi, Keshab M.; Pal, Priyanka; Bhandary, Subhrajyoti; Venugopala, Katharigatta N.; Chopra, Deepak; Nayak, Susanta K.
Crystal structure of a 1:1 cocrystal of nicotinamide with 2-chloro-5-nitrobenzoic acid
Acta Crystallographica Section E, 2019, 75, 1712-1718
2243153 CIF
HKL
Paper
C16 H11 Cl N2 O2P 1 21/c 16.6658; 30.16; 7.2193
90; 106.088; 90
1394.53Beemarao, M.; Silambarasan, S.; Nasser, A. Jamal Abdul; Purushothaman, M.; Ravichandran, K.
Crystal structure, DFT and Hirshfeld surface analysis of 2-amino-4-(2-chlorophenyl)-7-hydroxy-4<i>H</i>-benzo[1,2-<i>b</i>]pyran-3-carbonitrile
Acta Crystallographica Section E, 2019, 75, 1638-1642
2243154 CIF
HKL
Paper
C17 H14 N2 OP 1 21/c 110.819; 11.501; 11.187
90; 90.93; 90
1391.8Dadou, Said; Kansiz, Sevgi; Daoui, Said; El Kalai, Fouad; Baydere, Cemile; Saddik, Rafik; Karrouchi, Khalid; Dege, Necmi; Benchat, Noureddine
Crystal structures and Hirshfeld surface analyses of 4-benzyl-6-phenyl-4,5-dihydropyridazin-3(2<i>H</i>)-one and methyl 2-[5-(2,6-dichlorobenzyl)-6-oxo-3-phenyl-1,4,5,6-tetrahydropyridazin-1-yl]acetate
Acta Crystallographica Section E, 2019, 75, 1679-1684
2243155 CIF
HKL
Paper
C20 H16 Cl2 N2 O3P 1 21/c 111.273; 12.3808; 14.1405
90; 92.801; 90
1971.2Dadou, Said; Kansiz, Sevgi; Daoui, Said; El Kalai, Fouad; Baydere, Cemile; Saddik, Rafik; Karrouchi, Khalid; Dege, Necmi; Benchat, Noureddine
Crystal structures and Hirshfeld surface analyses of 4-benzyl-6-phenyl-4,5-dihydropyridazin-3(2<i>H</i>)-one and methyl 2-[5-(2,6-dichlorobenzyl)-6-oxo-3-phenyl-1,4,5,6-tetrahydropyridazin-1-yl]acetate
Acta Crystallographica Section E, 2019, 75, 1679-1684
2243156 CIF
HKL
Paper
C79 H60.5 N12 O13.25 S4P -112.5451; 15.9804; 19.434
86.671; 72.369; 74.167
3570.9Yennawar, Hemant P.; Thompson, Eric N.; Li, Jennie; Silverberg, Lee J.
Crystal structures of two solvated 2-aryl-3-phenyl-2,3-dihydro-4<i>H</i>-pyrido[3,2-<i>e</i>][1,3]thiazin-4-ones
Acta Crystallographica Section E, 2019, 75, 1689-1693
2243157 CIF
HKL
Paper
C22.5 H17 F N2 O SP 1 21/c 114.4481; 9.0141; 16.3427
90; 115.481; 90
1921.4Yennawar, Hemant P.; Thompson, Eric N.; Li, Jennie; Silverberg, Lee J.
Crystal structures of two solvated 2-aryl-3-phenyl-2,3-dihydro-4<i>H</i>-pyrido[3,2-<i>e</i>][1,3]thiazin-4-ones
Acta Crystallographica Section E, 2019, 75, 1689-1693
2243158 CIF
HKL
Paper
C30 H24 N6 Ni O2 S2P -17.2716; 10.4868; 10.8677
65.54; 88.893; 88.378
754.02Wellm, Carsten; Näther, Christian
Crystal structure, synthesis and thermal properties of bis(acetonitrile-κ<i>N</i>)bis(4-benzoylpyridine-κ<i>N</i>)bis(isothiocyanato-κ<i>N</i>)nickel(II)
Acta Crystallographica Section E, 2019, 75, 1685-1688
2243159 CIF
HKL
Paper
C21 H15 Cu F6 N2 O5P -19.3167; 10.0363; 11.8052
92.633; 97.31; 98.67
1080Kansiz, Sevgi; Meral, Seher; Dege, Necmi; Agar, Aysen Alaman; Fritsky, Igor O.
Crystal structure and Hirshfeld surface analysis of 2,2'-{(1<i>E</i>,1'<i>E</i>)-[ethane-1,2-diylbis(azanylylidene)]bis(methanylylidene)}bis[4-(trifluoromethoxy)phenol]copper(II) hydroquinone hemisolvate
Acta Crystallographica Section E, 2019, 75, 1729-1733
2243160 CIF
HKL
Paper
C19 H19 N5 O5P 16.9346; 8.438; 16.6963
79.826; 89.848; 80.488
948.03Gomes, Ligia R.; Low, John Nicolson; Wardell, James L.; de Souza, Marcus V. N.; da Costa, Cristiane F.
Crystal structure, Hirshfeld surface analysis and PIXEL calculations of a 1:1 epimeric mixture of 3-[(4-nitrobenzylidene)amino]-2(<i>R,S</i>)-(4-nitrophenyl)-5(<i>S</i>)-(propan-2-yl)imidazolidin-4-one
Acta Crystallographica Section E, 2019, 75, 1774-1782
2243161 CIF
HKL
Paper
C14 H14 N2 S2P 1 21/c 113.0656; 12.1787; 8.3471
90; 96.154; 90
1320.55Hoffmann, Jonas; Kuczmera, Thomas J.; Lork, Enno; Staubitz, Anne
Synthesis and crystal structure of (<i>E</i>)-1,2-bis[2-(methylsulfanyl)phenyl]diazene
Acta Crystallographica Section E, 2019, 75, 1808-1811
2243162 CIF
HKL
Paper
C24 H24 N2 O6I 1 2/a 116.9368; 15.413; 18.4562
90; 109.254; 90
4548.4Filali Baba, Yassir; Hayani, Sonia; Hökelek, Tuncer; Kaur, Manpreet; Jasinski, Jerry; Sebbar, Nada Kheira; Kandri Rodi, Youssef
Crystal structure, Hirshfeld surface analysis and DFT studies of ethyl 2-{4-[(2-ethoxy-2-oxoethyl)(phenyl)carbamoyl]-2-oxo-1,2-dihydroquinolin-1-yl}acetate
Acta Crystallographica Section E, 2019, 75, 1753-1758
2243163 CIF
HKL
Paper
C76 H66 N4 Ni2 O9P -113.2138; 14.1981; 17.537
82.696; 80.002; 80.784
3181.6Nikiforov, A. A.; Blinou, D. O.; Dubrov, E. N.; Panina, N. S.; Ponyaev, A. I.; Gurzhiy, V. V.; Eremin, A. V.; Fischer, A. I.
Crystal structures of two dimeric nickel diphenylacetate complexes
Acta Crystallographica Section E, 2019, 75, 1768-1773
2243164 CIF
HKL
Paper
C95 H81.5 N6.5 Ni2 O11P -115.6064; 17.744; 17.9143
70.462; 69.631; 64.726
4103.17Nikiforov, A. A.; Blinou, D. O.; Dubrov, E. N.; Panina, N. S.; Ponyaev, A. I.; Gurzhiy, V. V.; Eremin, A. V.; Fischer, A. I.
Crystal structures of two dimeric nickel diphenylacetate complexes
Acta Crystallographica Section E, 2019, 75, 1768-1773
2243165 CIF
HKL
Paper
C8 H8 Cu2 N4 OC 1 2/c 126.84; 4.83; 18.62
90; 119.91; 90
2092.3Partsevska, Sofiia V.; Sirenko, Valerii Y.; Terebilenko, Kateryna V.; Malinkin, Sergey O.; Gural'skiy, Il'ya A.
Crystal structure of <i>catena</i>-poly[[[(2-ethoxypyrazine-κ<i>N</i>)copper(I)]-di-μ~2~-cyanido] [copper(I)-μ~2~-cyanido]]
Acta Crystallographica Section E, 2019, 75, 1797-1800
2243166 CIF
Paper
C17 H17 N O5 ZnP -17.9134; 8.3006; 12.6413
97.873; 91.62; 91.991
821.57Saffon-Merceron, Nathalie; Vigroux, Alain; Hoffmann, Pascal
Crystal structure of a two-dimensional coordination polymer of formula [Zn(NDC)(DEF)] (H~2~NDC is naphthalene-2,6-dicarboxylic acid and DEF is <i>N</i>,<i>N</i>-diethylformamide)
Acta Crystallographica Section E, 2019, 75, 1759-1762
2243167 CIF
Paper
C9 H13 N3 O6 S2P 1 21/n 14.9411; 16.139; 16.426
90; 100.44; 90
1288.2Nehar, Oussama; Louhibi, Samira; Roisnel, Thierry
Synthesis and crystal structure of (<i>E</i>)-2-({2-[azaniumylidene(methylsulfanyl)methyl]hydrazinylidene}methyl)benzene-1,4-diol hydrogen sulfate
Acta Crystallographica Section E, 2019, 75, 1738-1740
2243168 CIF
HKL
Paper
C19 H18 O2P 1 21/c 110.9171; 9.1262; 15.2539
90; 108.618; 90
1440.24Seaman, Lewis S.; da Costa, Cristiane F.; de Souza, Marcus V. N.; Wardell, Solange M. S. V.; Wardell, James L.; Harrison, William T. A.
Different packing motifs mediated by weak interactions and polymorphism in the crystal structures of five 2-(benzylidene)benzosuberone derivatives
Acta Crystallographica Section E, 2019, 75, 1741-1747
2243169 CIF
HKL
Paper
C20 H20 O2P 1 21/c 112.6208; 14.9969; 8.39151
90; 108.681; 90
1504.61Seaman, Lewis S.; da Costa, Cristiane F.; de Souza, Marcus V. N.; Wardell, Solange M. S. V.; Wardell, James L.; Harrison, William T. A.
Different packing motifs mediated by weak interactions and polymorphism in the crystal structures of five 2-(benzylidene)benzosuberone derivatives
Acta Crystallographica Section E, 2019, 75, 1741-1747
2243170 CIF
HKL
Paper
C25 H22 O2P -19.287; 9.8727; 12.2944
67.098; 81.472; 61.989
915.92Seaman, Lewis S.; da Costa, Cristiane F.; de Souza, Marcus V. N.; Wardell, Solange M. S. V.; Wardell, James L.; Harrison, William T. A.
Different packing motifs mediated by weak interactions and polymorphism in the crystal structures of five 2-(benzylidene)benzosuberone derivatives
Acta Crystallographica Section E, 2019, 75, 1741-1747
2243171 CIF
HKL
Paper
C18 H15 Cl OP 1 21/n 110.6273; 11.6191; 12.1114
90; 108.777; 90
1415.92Seaman, Lewis S.; da Costa, Cristiane F.; de Souza, Marcus V. N.; Wardell, Solange M. S. V.; Wardell, James L.; Harrison, William T. A.
Different packing motifs mediated by weak interactions and polymorphism in the crystal structures of five 2-(benzylidene)benzosuberone derivatives
Acta Crystallographica Section E, 2019, 75, 1741-1747
2243172 CIF
HKL
Paper
C19 H15 N OP 1 21/c 112.4725; 7.1718; 15.9983
90; 106.12; 90
1374.79Seaman, Lewis S.; da Costa, Cristiane F.; de Souza, Marcus V. N.; Wardell, Solange M. S. V.; Wardell, James L.; Harrison, William T. A.
Different packing motifs mediated by weak interactions and polymorphism in the crystal structures of five 2-(benzylidene)benzosuberone derivatives
Acta Crystallographica Section E, 2019, 75, 1741-1747
2243173 CIF
HKL
Paper
C14 H22 Cu O16 S2P -16.1907; 7.201; 12.4919
90.31; 94.587; 111.087
517.57Squattrito, Philip J.; Lambright-Mutthamsetty, Kelly J.; Giolando, Patrick A.; Kirschbaum, Kristin
Crystal structures of two coordination isomers of copper(II) 4-sulfobenzoic acid hexahydrate and two mixed silver/potassium 4-sulfobenzoic acid salts
Acta Crystallographica Section E, 2019, 75, 1801-1807
2243174 CIF
HKL
Paper
C14 H22 Cu O16 S2P -16.438; 7.2431; 12.088
72.6; 77.2; 82.13
523Squattrito, Philip J.; Lambright-Mutthamsetty, Kelly J.; Giolando, Patrick A.; Kirschbaum, Kristin
Crystal structures of two coordination isomers of copper(II) 4-sulfobenzoic acid hexahydrate and two mixed silver/potassium 4-sulfobenzoic acid salts
Acta Crystallographica Section E, 2019, 75, 1801-1807
2243175 CIF
HKL
Paper
C7 H5 Ag0.69 K0.31 O5 SC 1 2/c 119.436; 15.644; 5.3355
90; 95.651; 90
1614.4Squattrito, Philip J.; Lambright-Mutthamsetty, Kelly J.; Giolando, Patrick A.; Kirschbaum, Kristin
Crystal structures of two coordination isomers of copper(II) 4-sulfobenzoic acid hexahydrate and two mixed silver/potassium 4-sulfobenzoic acid salts
Acta Crystallographica Section E, 2019, 75, 1801-1807
2243176 CIF
HKL
Paper
C7 H9 Ag0.2 K0.8 O7 SP 1 21/c 112.8018; 9.917; 8.4013
90; 94.747; 90
1062.93Squattrito, Philip J.; Lambright-Mutthamsetty, Kelly J.; Giolando, Patrick A.; Kirschbaum, Kristin
Crystal structures of two coordination isomers of copper(II) 4-sulfobenzoic acid hexahydrate and two mixed silver/potassium 4-sulfobenzoic acid salts
Acta Crystallographica Section E, 2019, 75, 1801-1807
2243177 CIF
HKL
Paper
C17 H13 Br F N O3 SP -17.6695; 10.6867; 12.2767
64.686; 80.76; 70.395
856.7Pham, Chien Thang; Mac, Dinh Hung; Bui, Thai Thanh Thu
Crystal structures of 2-(2-bromo-5-fluorophenyl)-8-ethoxy-3-nitro-2<i>H</i>-thiochromene and 2-(2-bromo-5-fluorophenyl)-7-methoxy-3-nitro-2<i>H</i>-thiochromene
Acta Crystallographica Section E, 2019, 75, 1783-1786
2243178 CIF
HKL
Paper
C16 H11 Br F N O3 SP 1 21/c 17.6231; 17.3484; 11.8345
90; 106.016; 90
1504.35Pham, Chien Thang; Mac, Dinh Hung; Bui, Thai Thanh Thu
Crystal structures of 2-(2-bromo-5-fluorophenyl)-8-ethoxy-3-nitro-2<i>H</i>-thiochromene and 2-(2-bromo-5-fluorophenyl)-7-methoxy-3-nitro-2<i>H</i>-thiochromene
Acta Crystallographica Section E, 2019, 75, 1783-1786
2243179 CIF
HKL
Paper
C13 H14 N2 O3P -16.0828; 9.4246; 11.1724
75.838; 83.099; 84.059
614.7Daoui, Said; Baydere, Cemile; El Kalai, Fouad; Saddik, Rafik; Dege, Necmi; Karrouchi, Khalid; Benchat, Noureddine
Crystal structure and Hirshfeld surface analysis of (<i>E</i>)-6-(4-hydroxy-3-methoxystyryl)-4,5-dihydropyridazin-3(2<i>H</i>)-one
Acta Crystallographica Section E, 2019, 75, 1734-1737
2243180 CIF
HKL
Paper
C36 H40 N4 Ni3 O16P 1 21/n 114.0309; 9.6335; 16.5804
90; 109.23; 90
2116.1Ajpi, Cesario; Suescun, Leopoldo; Leiva, Naviana; Lundblad, Anders; Lindbergh, Göran; Cabrera, Saul
Crystal structure and Hirshfeld surface analysis of poly[tris(μ~4~-benzene-1,4-dicarboxylato)tetrakis(dimethylformamide)trinickel(II)]: a two-dimensional coordination network
Acta Crystallographica Section E, 2019, 75, 1839-1843
2243181 CIF
HKL
Paper
C10 H6.02 Eu N1.01 O9P 1 21/c 111.8348; 11.3208; 10.6531
90; 110.275; 90
1338.86Thammakan, Supaphorn; Panyarat, Kitt; Rujiwatra, Apinpus
Organically pillared layer framework of [Eu(NH~2~‒BDC)(ox)(H~3~O)]
Acta Crystallographica Section E, 2019, 75, 1833-1838
2243182 CIF
HKL
Paper
C19 H36 I2 Ir P2 ZnP -19.5353; 10.1962; 14.6331
95.975; 91.255; 114.847
1280.58Taullaj, Fioralba; Lough, Alan J.; Fekl, Ulrich
An iridium complex with an unsupported Ir—Zn bond: diiodido(η^5^-pentamethylcyclopentadienyl)bis(trimethylphosphane)iridiumzinc(<i>Ir</i>—<i>Zn</i>) benzene hemisolvate
Acta Crystallographica Section E, 2019, 75, 1824-1827
2243183 CIF
HKL
Paper
C20 H26 N2 O9 SP 1 21 111.4868; 8.6444; 11.5561
90; 91.3762; 90
1147.15Abu-Zaied, Mamdouh A.; Elgemeie, Galal H.; Jones, Peter G.
Crystal structure of 4,6-dimethyl-2-[(2,3,4,6-tetra-<i>O</i>-acetyl-β-<small>D</small>-galactopyranosyl)sulfanyl]pyrimidine
Acta Crystallographica Section E, 2019, 75, 1820-1823
2243184 CIF
HKL
Paper
C20 H22 N8 O2P 1 21/c 113.2904; 10.2785; 14.4968
90; 100.254; 90
1948.71Byun, Young Min; Ume, Farwa; Ryu, Ji Yeon; Lee, Junseong; Park, Hyoung-Ryun
Crystal structure of 1,4-bis[5-(2-methoxyphenyl)-2<i>H</i>-tetrazol-2-yl]butane
Acta Crystallographica Section E, 2019, 75, 1844-1847
2243185 CIF
HKL
Paper
C14 H10 N2 OP 1 21/c 112.634; 4.9426; 16.778
90; 100.53; 90
1030.1Grathwol, Christoph W.; Chrysochos, Nicolas; Elvers, Benedict J.; Link, Andreas; Schulzke, Carola
Crystal structure of benzo[<i>h</i>]quinoline-3-carboxamide
Acta Crystallographica Section E, 2019, 75, 1828-1832
2243186 CIF
HKL
Paper
C16 H11 Cl N2 O5P b c n12.6336; 7.0701; 33.5956
90; 90; 90
3000.8Gotoh, Kazuma; Ishida, Hiroyuki
Crystal structure of 4-chloro-2-nitrobenzoic acid with 4-hydroxyquinoline: a disordered structure over two states of 4-chloro-2-nitrobenzoic acid‒quinolin-4(1<i>H</i>)-one (1/1) and 4-hydroxyquinolinium 4-chloro-2-nitrobenzoate
Acta Crystallographica Section E, 2019, 75, 1853-1856
2243187 CIF
HKL
Paper
C30 H44 O2 Si Zr2F d d 221.673; 28.296; 9.7466
90; 90; 90
5977Berg, David J.; Gajecki, Leah; Hill, Hunter; Twamley, Brendan
(μ-Di-<i>tert</i>-butylsilanediolato)bis[bis(η^5^-cyclopentadienyl)methylzirconium]
Acta Crystallographica Section E, 2019, 75, 1848-1852
2243198 CIF
HKL
Paper
C18 H22 N2 O4 S4 ZnC 1 2/c 122.869; 8.3212; 12.5627
90; 115.348; 90
2160.5Qadir, Adnan M.; Kansiz, Sevgi; Rosair, Georgina M.; Dege, Necmi; Safyanova, Inna S.
Crystal structure and Hirshfeld surface analysis of a zinc xanthate complex containing the 2,2'-bipyridine ligand
Acta Crystallographica Section E, 2019, 75, 1857-1860
2243199 CIF
HKL
Paper
C10 H10 N2 O SP 1 21/c 16.9932; 16.2916; 9.3544
90; 110.168; 90
1000.4Daoui, Said; Çınar, Emine Berrin; El Kalai, Fouad; Saddik, Rafik; Dege, Necmi; Karrouchi, Khalid; Benchat, Noureddine
Crystal structure, Hirshfeld surface analysis and DFT studies of 6-[(<i>E</i>)-2-(thiophen-2-yl)ethenyl]-4,5-dihydropyridazin-3(2<i>H</i>)-one
Acta Crystallographica Section E, 2019, 75, 1880-1883
2243200 CIF
HKL
Paper
C12 H10 O4P b c a9.4973; 7.9733; 26.682
90; 90; 90
2020.5Gonzalez-Carrillo, Gabino; Muñiz-Valencia, Roberto; García-Báez, Efren V.; Martínez-Martínez, Francisco J.
Crystal structure of a new polymorph of 3-acetyl-8-methoxy-2<i>H</i>-chromen-2-one
Acta Crystallographica Section E, 2019, 75, 1866-1870
2243201 CIF
HKL
Paper
C24 H21 Cr N8 S4P m c 2110.1068; 8.8168; 16.2628
90; 90; 90
1449.17Neumann, Tristan; Jess, Inke; Näther, Christian
Crystal structure of pyridinium tetraisothiocyanatodipyridinechromium(III) pyridine monosolvate
Acta Crystallographica Section E, 2019, 75, 1875-1879
2243202 CIF
HKL
Paper
C17 H21 N O4 SP 1 21/c 115.6801; 7.4311; 15.5968
90; 111.424; 90
1691.77Vu Quoc, Trung; Tran Thi Thuy, Duong; Phung Ngoc, Thanh; Vu Quoc, Manh; Nguyen, Hien; Duong Khanh, Linh; Tu Quang, Anh; Van Meervelt, Luc
Synthesis, crystal structure and Hirshfeld surface analysis of diethyl 2,6-dimethyl-4-(thiophen-3-yl)-1,4-dihydropyridine-3,5-dicarboxylate
Acta Crystallographica Section E, 2019, 75, 1861-1865
2243203 CIF
HKL
Paper
C78 H126 Eu O18 P3P 1 21/c 123.401; 10.6604; 33.543
90; 91.964; 90
8362.9Kalugin, Alexey E.; Lyssenko, Konstantin A.; Minyaev, Mikhail E.; Roitershtein, Dmitrii M.; Puntus, Lada N.; Varaksina, Evgenia A.; Nifant'ev, Ilya E.
Crystal structure of tris[bis(2,6-diisopropylphenyl) phosphato-κ<i>O</i>]pentakis(methanol-κ<i>O</i>)europium methanol monosolvate
Acta Crystallographica Section E, 2019, 75, 1892-1896
2243204 CIF
Paper
Al2 H12 N3 O12 P3P n a 218.98884; 17.01605; 8.67653
90; 90; 90
1327.11Nicholas, Christopher P.; Mowat, John P.S.; Broach, Robert W.
Structure refinement of (NH~4~)~3~Al~2~(PO~4~)~3~ prepared by ionothermal synthesis in phosphonium based ionic liquids ‒ a redetermination
Acta Crystallographica Section E, 2019, 75, 1897-1901
2243205 CIF
HKL
Paper
C46 H56 O15P 21 21 218.973; 20.9171; 23.9201
90; 90; 90
4489.5Yang, Hequn; Zhao, Jiangyu; Talipov, Samat; Izotova, Lidiya; Aisa, Hadji Akbar; Ibragimov, Bakhtiyar
Crystal and molecular structure of jatrophane diterpenoid (2<i>R</i>,3<i>R</i>,4<i>S</i>,5<i>R</i>,7<i>S</i>,8<i>S</i>,9<i>S</i>,13<i>S</i>,14<i>S</i>,15<i>R</i>)-2,3,8,9-tetraacetoxy-5,14-bis(benzoyloxy)-15-hydroxy-7-(isobutanoyloxy)jatropha-6(17),11(<i>E</i>)-diene
Acta Crystallographica Section E, 2019, 75, 1884-1887
2243206 CIF
HKL
Paper
C16 H12 O3P 1 21/c 13.851; 22.2541; 13.7837
90; 96.766; 90
1173.04Suchojad, Kamil; Dołega, Anna; Adamus-Grabicka, Angelika; Budzisz, Elżbieta; Małecka, Magdalena
Crystal structures of (<i>E</i>)-3-(4-hydroxybenzylidene)chroman-4-one and (<i>E</i>)-3-(3-hydroxybenzylidene)-2-phenylchroman-4-one
Acta Crystallographica Section E, 2019, 75, 1907-1913
2243207 CIF
HKL
Paper
C22 H16 O3P -15.3969; 11.6576; 12.944
91.992; 98.282; 97.568
797.66Suchojad, Kamil; Dołega, Anna; Adamus-Grabicka, Angelika; Budzisz, Elżbieta; Małecka, Magdalena
Crystal structures of (<i>E</i>)-3-(4-hydroxybenzylidene)chroman-4-one and (<i>E</i>)-3-(3-hydroxybenzylidene)-2-phenylchroman-4-one
Acta Crystallographica Section E, 2019, 75, 1907-1913
2243208 CIF
HKL
Paper
C36 H24 N6P -17.312; 8.847; 11.039
100.05; 102.247; 104.314
656.5Sedykh, Alexander E.; Kurth, Dirk G.; Müller-Buschbaum, Klaus
The crystal structure of the triclinic polymorph of 1,4-bis([2,2':6',2''-terpyridin]-4'-yl)benzene
Acta Crystallographica Section E, 2019, 75, 1947-1951
2243209 CIF
HKL
Paper
C11 H10 N2 OP 1 21/n 17.1507; 8.8177; 15.4602
90; 97.914; 90
965.52Saber, Asmaa; Srhir, Mohamed; Hökelek, Tuncer; Mague, Joel T.; Hamou Ahabchane, Noureddine; Sebbar, Nada Kheira; Essassi, El Mokhtar
Crystal structure, Hirshfeld surface analysis and interaction energy and DFT studies of 1-methyl-3-(prop-2-yn-1-yl)-2,3-dihydro-1<i>H</i>-1,3-benzodiazol-2-one
Acta Crystallographica Section E, 2019, 75, 1940-1946
2243210 CIF
HKL
C20 H18 N2 O3P -18.4213; 9.0739; 12.2238
106.501; 92.39; 100.75
875.43Daoui, Said; Baydere, Cemile; El Kalai, Fouad; Mahi, Lhassane; Dege, Necmi; Karrouchi, Khalid; Benchat, Noureddine
Crystal structure, Hirshfeld surface analysis and DFT studies of 2-[5-(4-methylbenzyl)-6-oxo-3-phenyl-1,6-dihydropyridazin-1-yl]acetic acid
Acta Crystallographica Section E, 2019, 75, 1925-1929
2243211 CIF
HKL
Paper
C13 H16 N4 O3P 1 21/n 18.4766; 9.4841; 16.9904
90; 94.308; 90
1362.05Ben Ali, Abdelkader; El Bakri, Youness; Lai, Chin-Hung; Sebhaoui, Jihad; El Ghayati, Lhoussaine; Essassi, El Mokhtar; Mague, Joel T.
Crystal structure, computational study and Hirshfeld surface analysis of ethyl (2<i>S</i>,3<i>R</i>)-3-(3-amino-1<i>H</i>-1,2,4-triazol-1-yl)-2-hydroxy-3-phenylpropanoate
Acta Crystallographica Section E, 2019, 75, 1919-1924
2243212 CIF
HKL
Paper
C14 H12 Br N O2P -18.2301; 10.1593; 15.9428
102.496; 90.597; 103.213
1264.46Doğan, Onur Erman; Dege, Necmi; Ağar, Erbil; Fritsky, Igor O.
(<i>E</i>)-3-{[(2-Bromo-3-methylphenyl)imino]methyl}benzene-1,2-diol: crystal structure and Hirshfeld surface analysis
Acta Crystallographica Section E, 2019, 75, 1930-1933
2243213 CIF
Paper
C14 H16 N2 O2 S2I 41 c d28.3247; 28.3247; 7.282
90; 90; 90
5842.3Bibila Mayaya Bisseyou, Yvon; Ouattara, Mahama; Soro, Pénétjiligué Adama; Yao-Kakou, R. C. A.; Tenon, Abodou Jules
Crystal structure, Hirshfeld surface analysis and contact enrichment ratios of 1-(2,7-dimethylimidazo[1,2-<i>a</i>]pyridin-3-yl)-2-(1,3-dithiolan-2-ylidene)ethanone monohydrate
Acta Crystallographica Section E, 2019, 75, 1934-1939
2243606 CIF
HKL
Paper
C10 H20 N2 O8 P2 ZnP 1 21/n 18.8455; 16.4492; 11.2721
90; 97.338; 90
1626.67Soriano, Josemaria S.; Galeas, Bryan E.; Garrett, Paul; Flores, Ryan A.; Pinedo, Juan L.; Kohlgruber, Tsuyoshi A.; Felton, Daniel; Adelani, Pius O.
<i>In situ</i> decarbonylation of <i>N</i>,<i>N</i>-dimethylformamide to form dimethylammonium cations in the hybrid framework compound {[(CH~3~)~2~NH~2~]~2~[Zn{O~3~PC~6~H~2~(OH)~2~PO~3~}]}~<i>n~</i>
Acta Crystallographica Section E, 2019, 75, 1540-1543
2243607 CIF
HKL
Paper
C24 H10 N4 S3P 1 21/n 114.2567; 39.028; 15.2295
90; 100.136; 90
8341.6Qin, Qian; Mague, Joel T.; Gould, Haley E.; Vasquez, Samuel E.; Heyer, Anthony E.
Crystal structures of two charge‒transfer complexes of benzo[1,2-<i>c</i>:3,4-<i>c</i>':5,6-<i>c</i>'']trithiophene (<i>D</i>~3<i>h~</i>-BTT)
Acta Crystallographica Section E, 2019, 75, 1573-1577
2243608 CIF
HKL
Paper
C79 H14 S3P 1 21 110.0139; 17.4327; 13.0286
90; 108.816; 90
2152.8Qin, Qian; Mague, Joel T.; Gould, Haley E.; Vasquez, Samuel E.; Heyer, Anthony E.
Crystal structures of two charge‒transfer complexes of benzo[1,2-<i>c</i>:3,4-<i>c</i>':5,6-<i>c</i>'']trithiophene (<i>D</i>~3<i>h~</i>-BTT)
Acta Crystallographica Section E, 2019, 75, 1573-1577
2243609 CIF
HKL
Paper
C26 H22 Cd N8 O6C 1 2/c 114.6899; 15.025; 12.2269
90; 106.843; 90
2582.9Kim, Yongtae; Kang, Sung Kwon
Crystal structure of bis[2-(1<i>H</i>-benzimidazol-2-yl-κ<i>N</i>^3^)aniline-κ<i>N</i>]bis(nitrato-κ<i>O</i>)cadmium(II)
Acta Crystallographica Section E, 2019, 75, 1463-1466
2243610 CIF
HKL
Paper
C67 H54 N4 O5 ZnP 1 21/c 127.2823; 19.7693; 9.9674
90; 94.614; 90
5358.5Kashiwagi, Yukiyasu; Kubono, Koji; Tamai, Toshiyuki
Crystal structure of <i>catena</i>-poly[[[bis(3-oxo-1,3-diphenylprop-1-enolato-κ^2^<i>O</i>,<i>O</i>')zinc(II)]-μ~2~-tris[4-(pyridin-3-yl)phenyl]amine-κ^2^<i>N</i>:<i>N</i>'] tetrahydrofuran monosolvate]
Acta Crystallographica Section E, 2019, 75, 1432-1435
2243611 CIF
HKL
Paper
Ba Cu2.6 Zn2.4P n m a12.9858; 5.2162; 6.6804
90; 90; 90
452.507Simura, Rayko; Yamane, Hisanori
α-SrZn~5~-Type solid solution, BaZn~2.6~Cu~2.4~
Acta Crystallographica Section E, 2019, 75, 1490-1493
2243612 CIF
HKL
Paper
F6 H10 N4 SiP 1 21/n 15.9496; 5.2484; 11.0029
90; 100.245; 90
338.1Ouasri, Ali; Lambarki, Fatima; Rhandour, Ali; Saadi, Mohamed; El Ammari, Lahcen
Crystal structure and Hirshfeld surface analysis of bis[hydrazinium(1+)] hexafluoridosilicate: (N~2~H~5~)~2~SiF~6~
Acta Crystallographica Section E, 2019, 75, 1507-1510
2243613 CIF
HKL
C17 H24 N4 O5 Pt S2P -16.5264; 8.9024; 18.9261
82.228; 87.074; 74.739
1050.96Arafath, Md. Azharul; Kwong, Huey Chong; Adam, Farook
The crystal structure of ((cyclohexylamino){(<i>Z</i>)-2-[(<i>E</i>)-5-methoxy-3-nitro-2-oxidobenzylidene-κ<i>O</i>]hydrazin-1-ylidene-κ<i>N</i>^2^}methanethiolato-κ<i>S</i>)(dimethyl sulfoxide-κ<i>S</i>)platinum(II): a supramolecular two-dimensional network
Acta Crystallographica Section E, 2019, 75, 1486-1489

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