Information card for entry 1574193

Structure parameters

• Formula: C82 H78 S2
• Calculated formula: C82 H78 S2
• Title of publication: Thiophene-backbone Arcuate Graphene Nanoribbons: Shotgun Synthesis and Length dependent Properties
• Authors of publication: zhang, Ruiying; Chen, Xinyu; Zhu, Ling-Yun; Huang, Yanxia; Zhai, Ziang; wang, Qiang; wang, lingding; wang, Taosong; wang, weizhen; Ye, Ke-Yin; Li, Yuanming
• Journal of publication: Chemical Science
• Year of publication: 2025
• a: 10.3995 ± 0.0002 Å
• b: 16.4712 ± 0.0002 Å
• c: 40.5773 ± 0.0005 Å
• α: 90°
• β: 91.448 ± 0.001°
• γ: 90°
• Cell volume: 6948.36 ± 0.18 ų
• Cell temperature: 100 ± 0.9 K
• Ambient diffraction temperature: 100 ± 0.9 K
• Number of distinct elements: 3
• 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: 0.0897
• Residual factor for significantly intense reflections: 0.0791
• Weighted residual factors for significantly intense reflections: 0.2132
• Weighted residual factors for all reflections included in the refinement: 0.2214
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.3405 Å
• Diffraction radiation type: micro-focusmetaljet
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No