Information card for entry 4322221

Structure parameters

• Chemical name: Hexachloro-bis(tripropylphosphine)-di-rhenium (II, III), 1,7-isomer, tetrabutylammonium salt
• Formula: C34 H78 Cl6 N P2 Re2
• Calculated formula: C34 H78 Cl6 N P2 Re2
• Title of publication: Mixed Chloride/Phosphine Complexes of the Dirhenium Core. 6. Rare or Unprecedented Isomers of [Re2Cl6(PR3)2] Stoichiometry
• Authors of publication: F. Albert Cotton; Evgeny V. Dikarev; Marina A. Petrukhina
• Journal of publication: Inorganic Chemistry
• Year of publication: 1999
• Journal volume: 38
• Pages of publication: 3889 - 3894
• a: 12.758 ± 0.001 Å
• b: 15.755 ± 0.005 Å
• c: 24.16 ± 0.003 Å
• α: 90°
• β: 104.22 ± 0.01°
• γ: 90°
• Cell volume: 4707.4 ± 1.7 ų
• Cell temperature: 213 ± 2 K
• Ambient diffraction temperature: 213 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0407
• Residual factor for significantly intense reflections: 0.0341
• Weighted residual factors for all reflections: 0.0803
• Weighted residual factors for significantly intense reflections: 0.0753
• Goodness-of-fit parameter for all reflections: 1.122
• Goodness-of-fit parameter for significantly intense reflections: 1.121
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No