Information card for entry 7018115

Structure parameters

• Formula: C171 H42 N2 O7 P2 Ru2 S6
• Calculated formula: C171 H40 N2 O7 P2 Ru2 S6
• Title of publication: Synthesis of the phosphino-fullerene PPh(2)(o-C(6)H(4))(CH(2)NMeCH)C(60) and its function as an η(1)-P or η(3)-P,C(2) ligand.
• Authors of publication: Chen, Chia-Hsiang; Chen, Chi-Shian; Dai, Huei-Fang; Yeh, Wen-Yann
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 10
• Pages of publication: 3030 - 3037
• a: 10.0828 ± 0.0013 Å
• b: 16.351 ± 0.002 Å
• c: 16.5332 ± 0.0019 Å
• α: 84.296 ± 0.007°
• β: 77.77 ± 0.007°
• γ: 77.84 ± 0.009°
• Cell volume: 2599.8 ± 0.6 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.2496
• Residual factor for significantly intense reflections: 0.1196
• Weighted residual factors for significantly intense reflections: 0.309
• Weighted residual factors for all reflections included in the refinement: 0.3715
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No