Information card for entry 2228470

Structure parameters

• Chemical name: <i>N</i>,<i>N</i>'-Bis(3-phenylprop-2-en-1-ylidene)-2,2'-disulfanediyldianiline
• Formula: C30 H24 N2 S2
• Calculated formula: C30 H24 N2 S2
• SMILES: c1(c(cccc1)SSc1c(cccc1)/N=C/C=C/c1ccccc1)/N=C/C=C/c1ccccc1
• Title of publication: <i>N</i>,<i>N</i>'-Bis(3-phenylprop-2-en-1-ylidene)-2,2'-disulfanediyldianiline
• Authors of publication: Raftery, James; Jhaumeer-Laulloo, Sabina; Bhowon, Minu G.; Chikhooree, Kiran; Joule, John A.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 12
• Pages of publication: o3307
• a: 20.2393 ± 0.0013 Å
• b: 9.1593 ± 0.0006 Å
• c: 13.5335 ± 0.0008 Å
• α: 90°
• β: 104.995 ± 0.001°
• γ: 90°
• Cell volume: 2423.4 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0559
• Residual factor for significantly intense reflections: 0.0468
• Weighted residual factors for significantly intense reflections: 0.1075
• Weighted residual factors for all reflections included in the refinement: 0.1121
• Goodness-of-fit parameter for all reflections included in the refinement: 1.076
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes