Information card for entry 4309622

Structure parameters

• Formula: C72 H88 N16 O13 Re4 W2
• Calculated formula: C72 H88 N16 O13 Re4 W2
• Title of publication: One-Dimensional Supramolecular Assemblies Based on a Re2(III,III) Synthon and Their Solid-State Phosphorescence
• Authors of publication: Michael Q. Dequeant; Robert McGuire; David R. McMillin; Tong Ren
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 6521 - 6523
• a: 12.5968 ± 0.0004 Å
• b: 19.5102 ± 0.0006 Å
• c: 34.6185 ± 0.0011 Å
• α: 90°
• β: 93.803 ± 0.001°
• γ: 90°
• Cell volume: 8489.3 ± 0.5 ų
• Cell temperature: 300 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.1209
• Residual factor for significantly intense reflections: 0.058
• Weighted residual factors for significantly intense reflections: 0.122
• Weighted residual factors for all reflections included in the refinement: 0.1503
• Goodness-of-fit parameter for all reflections included in the refinement: 1.001
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No