Information card for entry 4341285

Structure parameters

• Formula: C84 H72 Cl11.98 N24 Ru2 W4
• Calculated formula: C84 H72 Cl11.9804 N24 Ru2 W4
• Title of publication: Heterometallic Multiple Bonding: Delocalized Three-Center σ and π Bonding in Chains of 4d and 5d Transition Metals.
• Authors of publication: Brogden, David W.; Berry, John F.
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 21
• Pages of publication: 11354 - 11356
• a: 19.7217 ± 0.0005 Å
• b: 29.7782 ± 0.0008 Å
• c: 16.7192 ± 0.0004 Å
• α: 90°
• β: 114.573 ± 0.0012°
• γ: 90°
• Cell volume: 8929.5 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 99.99 K
• Number of distinct elements: 6
• 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: 0.0596
• Residual factor for significantly intense reflections: 0.0418
• Weighted residual factors for significantly intense reflections: 0.0886
• Weighted residual factors for all reflections included in the refinement: 0.0978
• Goodness-of-fit parameter for all reflections included in the refinement: 1.152
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No