Information card for entry 2214977

Structure parameters

• Chemical name: (2<i>Z</i>,3<i>E</i>)-2,3-Bis(2-thienylmethylene)succinic acid methanol hemisolvate
• Formula: C14.5 H12 O4.5 S2
• Calculated formula: C14.5 H12 O4.5 S2
• Title of publication: (2<i>Z</i>,3<i>E</i>)-2,3-Bis(2-thienylmethylene)succinic acid methanol hemisolvate
• Authors of publication: K. N. Venugopala; Deepak Chopra; C. R. Girija; Noor Shahina Begum; G. K. Rao
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 9
• Pages of publication: o3722 - o3722
• a: 15.042 ± 0.007 Å
• b: 13.295 ± 0.006 Å
• c: 16.219 ± 0.007 Å
• α: 90°
• β: 101.792 ± 0.007°
• γ: 90°
• Cell volume: 3175 ± 2 ų
• Cell temperature: 290 ± 2 K
• Ambient diffraction temperature: 290 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0794
• Residual factor for significantly intense reflections: 0.0724
• Weighted residual factors for significantly intense reflections: 0.2223
• Weighted residual factors for all reflections included in the refinement: 0.2326
• Goodness-of-fit parameter for all reflections included in the refinement: 1.119
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes