Information card for entry 2227901

Structure parameters

• Chemical name: <i>N</i>,<i>N</i>'-Bis[(<i>E</i>)-(3-methyl-2-thienyl)methylidene]ethane- 1,2-diamine
• Formula: C14 H16 N2 S2
• Calculated formula: C14 H16 N2 S2
• SMILES: Cc1ccsc1/C=N/CC/N=C/c1sccc1C
• Title of publication: <i>N</i>,<i>N</i>'-Bis[(<i>E</i>)-(3-methyl-2-thienyl)methylidene]ethane-1,2-diamine
• Authors of publication: Prasath, R.; Bhavana, P.; Ng, Seik Weng; Tiekink, Edward R. T.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 11
• Pages of publication: o2884
• a: 8.761 ± 0.0006 Å
• b: 8.9502 ± 0.0006 Å
• c: 8.9853 ± 0.0006 Å
• α: 92.76 ± 0.001°
• β: 91.653 ± 0.001°
• γ: 106.066 ± 0.001°
• Cell volume: 675.61 ± 0.08 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.035
• Residual factor for significantly intense reflections: 0.031
• Weighted residual factors for significantly intense reflections: 0.095
• Weighted residual factors for all reflections included in the refinement: 0.1
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes