Information card for entry 7237853

Structure parameters

• Formula: C68 H58 Au Cl P4 Pt S2
• Calculated formula: C68 H58 Au Cl P4 Pt S2
• Title of publication: Modulation of the conductance in platinum(ii) bis(acetylide) molecules through “gating” metal ions
• Authors of publication: Duan, Ping; Liu, Junyang; Wang, Jin-Yun; Chen, Lichuan; Wang, Fei; Zhang, Qian-Chong; Hong, Wenjing; Chen, Zhong-Ning
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2019
• Journal volume: 7
• Journal issue: 24
• Pages of publication: 7259
• a: 10.2585 ± 0.0006 Å
• b: 23.583 ± 0.0016 Å
• c: 24.708 ± 0.0016 Å
• α: 90°
• β: 95.358 ± 0.002°
• γ: 90°
• Cell volume: 5951.4 ± 0.7 ų
• Cell temperature: 260 ± 2 K
• Ambient diffraction temperature: 260 ± 2 K
• Number of distinct elements: 7
• 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: 0.051
• Residual factor for significantly intense reflections: 0.0463
• Weighted residual factors for significantly intense reflections: 0.1256
• Weighted residual factors for all reflections included in the refinement: 0.1289
• Goodness-of-fit parameter for all reflections included in the refinement: 1.081
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No