Information card for entry 4132831

Structure parameters

• Formula: C131 H48 S5.2
• Calculated formula: C130.998 H48 S5.1664
• Title of publication: Synthesis and Size-Dependent Properties of [12], [16], and [24]Carbon Nanobelts.
• Authors of publication: Povie, Guillaume; Segawa, Yasutomo; Nishihara, Taishi; Miyauchi, Yuhei; Itami, Kenichiro
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2018
• Journal volume: 140
• Journal issue: 31
• Pages of publication: 10054 - 10059
• a: 21.2743 ± 0.0006 Å
• b: 21.2743 ± 0.0006 Å
• c: 39.683 ± 0.0013 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 15554.1 ± 0.8 ų
• Cell temperature: 123 K
• Ambient diffraction temperature: 123 K
• Number of distinct elements: 3
• Space group number: 173
• Hermann-Mauguin space group symbol: P 63
• Hall space group symbol: P 6c
• Residual factor for all reflections: 0.2331
• Residual factor for significantly intense reflections: 0.1554
• Weighted residual factors for significantly intense reflections: 0.3771
• Weighted residual factors for all reflections included in the refinement: 0.4369
• Goodness-of-fit parameter for all reflections included in the refinement: 1.596
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No