Information card for entry 7237854

Structure parameters

• Formula: C85 H78 Au2 Cl8 O8 P6 Pt S2
• Calculated formula: C85 H78 Au2 Cl8 O8 P6 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: 20.2336 ± 0.0005 Å
• b: 19.6969 ± 0.0005 Å
• c: 22.1531 ± 0.0005 Å
• α: 90°
• β: 95.746 ± 0.001°
• γ: 90°
• Cell volume: 8784.5 ± 0.4 ų
• Cell temperature: 121 ± 2 K
• Ambient diffraction temperature: 121 ± 2 K
• Number of distinct elements: 8
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0585
• Residual factor for significantly intense reflections: 0.0515
• Weighted residual factors for significantly intense reflections: 0.1304
• Weighted residual factors for all reflections included in the refinement: 0.1353
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No