Information card for entry 2101944

Structure parameters

• Common name: Molybdenum Pentachloride
• Chemical name: δ-Molybdenum Pentachloride
• Formula: Cl10 Mo2
• Calculated formula: Cl10 Mo2
• SMILES: [Mo]1([Cl][Mo]([Cl]1)(Cl)(Cl)(Cl)Cl)(Cl)(Cl)(Cl)Cl
• Title of publication: Three New Polymorphic Forms of Molybdenum Pentachloride
• Authors of publication: Beck, J.; Wolf, F.
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 1997
• Journal volume: 53
• Journal issue: 6
• Pages of publication: 895 - 903
• a: 9.4682 ± 0.0007 Å
• b: 11.7496 ± 0.0009 Å
• c: 12.1619 ± 0.0011 Å
• α: 90°
• β: 108.879 ± 0.005°
• γ: 90°
• Cell volume: 1280.2 ± 0.18 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 2
• 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: 0.0629
• Residual factor for significantly intense reflections: 0.0359
• Weighted residual factors for all reflections: 0.1188
• Weighted residual factors for significantly intense reflections: 0.0987
• Goodness-of-fit parameter for all reflections: 1.038
• Goodness-of-fit parameter for significantly intense reflections: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes