Information card for entry 2000687

Structure parameters

• Formula: C21 H18 Cl N3 O S
• Calculated formula: C21 H18 Cl N3 O S
• Title of publication: Mesoionic compounds. 3. Structure of the hydrochloride of 5(4-methoxyphenyl)-4-phenyl-1,3,4-thiadiazolium-2-phenylaminide
• Authors of publication: Cheung, K.-K.; Echevarria, A.; Galembeck, S.; Maciel, M. A. M.; Miller, J.; Rumjanek, V. M.; Simas, A. M.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1992
• Journal volume: 48
• Journal issue: 8
• Pages of publication: 1471 - 1474
• a: 15.809 ± 0.004 Å
• b: 12.207 ± 0.002 Å
• c: 19.772 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3815.6 ± 1.5 ų
• Number of distinct elements: 6
• Hermann-Mauguin space group symbol: P b c a
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: Mo
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No