Information card for entry 8100555

Structure parameters

• Formula: C15 H17 N5 S2
• Calculated formula: C15 H17 N5 S2
• SMILES: s1c(nc(c1C1=NNC(=S)N1c1ccc(N(C)C)cc1)C)C
• Title of publication: Crystal structure of 4-[4-(dimethylamino)phenyl]-5-(2,4-dimethyl-1, 3-thiazol-5-yl)-2,4-dihydro-3H-1,2,4-triazol-3-thione, C~15~H~17~N~5~S~2~
• Authors of publication: Ramazani, Ali; Morsali, Ali; Jamali, Fahimeh; Gouranlou, Farideh; Jalilian, Amir Reza; Momeni-Movahhed, Abolfazle
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2002
• Journal volume: 217
• Journal issue: 1
• Pages of publication: 149 - 150
• a: 7.8216 ± 0.0012 Å
• b: 8.3549 ± 0.0013 Å
• c: 13.925 ± 0.002 Å
• α: 75.651 ± 0.004°
• β: 82.732 ± 0.003°
• γ: 62.609 ± 0.003°
• Cell volume: 782.7 ± 0.2 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No