Information card for entry 7102265

Structure parameters

• Formula: C34 H82 Cl5 N4 P5 Re6 Se8
• Calculated formula: C34 H75 Cl5 N4 P5 Re6 Se8
• Title of publication: Synthesis and electrochemical study of the first tetrazolate hexanuclear rhenium cluster complex.
• Authors of publication: Szczepura, Lisa F; Oh, Meghan K; Knott, Stanley A
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2007
• Journal issue: 44
• Pages of publication: 4617 - 4619
• a: 15.7625 ± 0.0011 Å
• b: 16.9028 ± 0.0011 Å
• c: 24.0359 ± 0.0016 Å
• α: 90°
• β: 100.974 ± 0.001°
• γ: 90°
• Cell volume: 6286.8 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• 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: 0.0683
• Residual factor for significantly intense reflections: 0.037
• Weighted residual factors for significantly intense reflections: 0.1031
• Weighted residual factors for all reflections included in the refinement: 0.1195
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No