Information card for entry 4309623

Structure parameters

• Formula: C44 H48 N8 O6 Re2
• Calculated formula: C44 H48 N8 O6 Re2
• 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: 21.1694 ± 0.0016 Å
• b: 10.514 ± 0.0008 Å
• c: 21.321 ± 0.003 Å
• α: 90°
• β: 104.496 ± 0.001°
• γ: 90°
• Cell volume: 4594.4 ± 0.8 ų
• Cell temperature: 300 ± 2 K
• Ambient diffraction temperature: 300 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/a 1
• Hall space group symbol: -I 2ya
• Residual factor for all reflections: 0.0827
• Residual factor for significantly intense reflections: 0.0398
• Weighted residual factors for significantly intense reflections: 0.0709
• Weighted residual factors for all reflections included in the refinement: 0.0817
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No