Information card for entry 7702712

Structure parameters

• Chemical name: μ-hydrido-μ-naphthylthiolato-ax-triphenylphosphine- heptacarbonyl-dirhenium
• Formula: C42 H31 O7 P Re2 S
• Calculated formula: C42 H30 O7 P Re2 S
• Title of publication: Substitution reactivity of the hydrido sulfido bridged dirhenium complex [Re2(µ-H)(µ-Snaph)(CO)8] (naph = 2-naphthyl)
• Authors of publication: Egold, Hans; Schwarze, Detlef; Flörke, Ulrich
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2002
• Journal issue: 6
• Pages of publication: 1078
• a: 11.03 ± 0.006 Å
• b: 12.673 ± 0.006 Å
• c: 15.972 ± 0.006 Å
• α: 76.24 ± 0.02°
• β: 71.27 ± 0.02°
• γ: 67.31 ± 0.02°
• Cell volume: 1934.1 ± 1.6 ų
• Cell temperature: 208 ± 2 K
• Ambient diffraction temperature: 208 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0455
• Residual factor for significantly intense reflections: 0.0355
• Weighted residual factors for all reflections: 0.0927
• Weighted residual factors for significantly intense reflections: 0.0873
• Goodness-of-fit parameter for all reflections: 1.051
• Goodness-of-fit parameter for significantly intense reflections: 1.08
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No