Information card for entry 7105250

Structure parameters

• Formula: C42 H32 N14 Ru3 S2
• Calculated formula: C42 H32 N14 Ru3 S2
• Title of publication: On the tuning of electric conductance of extended metal atom chains via axial ligands for [Ru3(μ3-dpa)4(X)2]0/+ (X = NCS−, CN−)
• Authors of publication: Shih, Kai-Neng; Huang, Min-Jie; Lu, Hao-Cheng; Fu, Ming-Dung; Kuo, Ching-Kuo; Huang, Gin-Chen; Lee, Gene-Hsiang; Chen, Chun-hsien; Peng, Shie-Ming
• Journal of publication: Chemical Communications
• Year of publication: 2010
• Journal volume: 46
• Journal issue: 8
• Pages of publication: 1338
• a: 10.8376 ± 0.0006 Å
• b: 10.8376 ± 0.0006 Å
• c: 17.6873 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2077.44 ± 0.18 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 87
• Hermann-Mauguin space group symbol: I 4/m
• Hall space group symbol: -I 4
• Residual factor for all reflections: 0.1061
• Residual factor for significantly intense reflections: 0.0596
• Weighted residual factors for significantly intense reflections: 0.1644
• Weighted residual factors for all reflections included in the refinement: 0.1874
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No