Information card for entry 1508958

Structure parameters

• Formula: C26 H24 N O2 P S
• Calculated formula: C26 H24 N O2 P S
• SMILES: S(=O)(=O)(N=P1(C(=C2C(=C1c1ccccc1)CCC2)c1ccccc1)c1ccccc1)C
• Title of publication: Synthesis and Charge-Carrier Transport Properties of Poly(phosphole P-alkanesulfonylimide)s.
• Authors of publication: Matano, Yoshihiro; Ohkubo, Hiroshi; Honsho, Yoshihito; Saito, Arihiro; Seki, Shu; Imahori, Hiroshi
• Journal of publication: Organic letters
• Year of publication: 2013
• Journal volume: 15
• Journal issue: 4
• Pages of publication: 932 - 935
• a: 11.06 ± 0.003 Å
• b: 18.268 ± 0.005 Å
• c: 21.576 ± 0.006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4359 ± 2 ų
• Cell temperature: 143 ± 2 K
• Ambient diffraction temperature: 143 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0704
• Residual factor for significantly intense reflections: 0.0568
• Weighted residual factors for significantly intense reflections: 0.1424
• Weighted residual factors for all reflections included in the refinement: 0.1516
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No