Information card for entry 2012772

Structure parameters

• Common name: Ethyl 2-{[5-(ethoxycarbonyl)-3,4-dimethyl-1,3-thiazol-2(3H)-ylidene]hydrazono}- 3,4-dimethyl-2,3-dihydro-1,3-thiazole-5-carboxylate 7,7,8,8-tetracyano-p-quinodimethane (1/1)
• Formula: C28 H26 N8 O4 S2
• Calculated formula: C28 H26 N8 O4 S2
• Title of publication: A neutral complex of an azino‒DTDAF compound with TCNQ
• Authors of publication: Toplak, Renata; Lorcy, Dominique
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 6
• Pages of publication: o370 - o372
• a: 20.96 ± 0.004 Å
• b: 6.8198 ± 0.0014 Å
• c: 11.73 ± 0.002 Å
• α: 90°
• β: 118.67 ± 0.03°
• γ: 90°
• Cell volume: 1471.2 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.057
• Residual factor for significantly intense reflections: 0.041
• Weighted residual factors for significantly intense reflections: 0.102
• Weighted residual factors for all reflections included in the refinement: 0.108
• Goodness-of-fit parameter for all reflections included in the refinement: 0.97
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes