Information card for entry 4319935

Structure parameters

• Common name: alpha isomer
• Formula: C16 H40 Cl12 N2 O6 W6
• Calculated formula: C16 H40 Cl12 N2 O6 W6
• Title of publication: Edge-Bridged Octahedral Tungsten-Oxygen-Chlorine Clusters: Synthesis and Characterization of Two D3d-Symmetric [W6O6Cl12]2- Isomers and [W6O7Cl11]3-
• Authors of publication: Nathan R. M. Crawford; Jeffrey R. Long
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 3456 - 3462
• a: 8.4643 ± 0.001 Å
• b: 22.526 ± 0.002 Å
• c: 22.743 ± 0.002 Å
• α: 118.684 ± 0.004°
• β: 90.71 ± 0.001°
• γ: 91.511 ± 0.004°
• Cell volume: 3801.3 ± 0.7 ų
• Cell temperature: 155 ± 2 K
• Ambient diffraction temperature: 155 ± 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: 0.1514
• Residual factor for significantly intense reflections: 0.0763
• Weighted residual factors for all reflections: 0.2005
• Weighted residual factors for significantly intense reflections: 0.1746
• Goodness-of-fit parameter for all reflections: 1.067
• Goodness-of-fit parameter for significantly intense reflections: 1.258
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No