Information card for entry 7201732

Structure parameters

• Formula: C31 H31 Cl2 N O8 Pt S
• Calculated formula: C31 H31 Cl2 N O8 Pt S
• Title of publication: Columnar mesophases from half-discoid platinum cyclometalated metallomesogens
• Authors of publication: Venkatesan, Koushik; Kouwer, Paul H. J.; Yagi, Shigeyuki; Müller, Peter; Swager, Timothy M.
• Journal of publication: Journal of Materials Chemistry
• Year of publication: 2008
• Journal volume: 18
• Journal issue: 4
• Pages of publication: 400
• a: 20.996 ± 0.0019 Å
• b: 10.4617 ± 0.001 Å
• c: 15.1265 ± 0.0014 Å
• α: 90°
• β: 112.473 ± 0.001°
• γ: 90°
• Cell volume: 3070.3 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.015
• Residual factor for significantly intense reflections: 0.0142
• Weighted residual factors for significantly intense reflections: 0.0248
• Weighted residual factors for all reflections included in the refinement: 0.025
• Goodness-of-fit parameter for all reflections included in the refinement: 0.988
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No