Information card for entry 4323440

Structure parameters

• Common name: trans-Mo(O)(S)(dppee)~2~
• Chemical name: trans-bis(cis-1,2-bis(diphenylphosphino)ethylene-P,P')-oxo-sulfido- molybdenum (IV)
• Formula: C52 H44 Mo O P4 S
• Calculated formula: C52 H44 Mo O P4 S
• Title of publication: Mononuclear Molybdenum(IV) Complexes with Two Multiply Bonded Chalcogen Ligands in Trans Configuration and Chelating Biphosphine Ligands
• Authors of publication: F. Albert Cotton; Günter Schmid
• Journal of publication: Inorganic Chemistry
• Year of publication: 1997
• Journal volume: 36
• Pages of publication: 2267 - 2278
• a: 10.04 ± 0.001 Å
• b: 10.563 ± 0.001 Å
• c: 12.162 ± 0.002 Å
• α: 75.3 ± 0.01°
• β: 85.93 ± 0.01°
• γ: 63.21 ± 0.01°
• Cell volume: 1112.3 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0301
• Residual factor for significantly intense reflections: 0.0299
• Weighted residual factors for all reflections: 0.0981
• Weighted residual factors for significantly intense reflections: 0.098
• Goodness-of-fit parameter for all reflections: 1.102
• Goodness-of-fit parameter for significantly intense reflections: 1.105
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No