Information card for entry 4318950

Structure parameters

• Formula: C14.5 H24 Br4 N6 O7.5 Re2
• Calculated formula: C14.5 H24 Br4 N6 O7.5 Re2
• Title of publication: Oxorhenium(V) Complexes with the Non-Sulfur-Containing Amino Acid Histidine
• Authors of publication: Christian Tessier; Fernande D. Rochon; André L. Beauchamp
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 6527 - 6536
• a: 15.349 ± 0.003 Å
• b: 9.686 ± 0.002 Å
• c: 18.658 ± 0.004 Å
• α: 90°
• β: 102.74 ± 0.03°
• γ: 90°
• Cell volume: 2705.6 ± 1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 5
• Hermann-Mauguin space group symbol: I 1 2 1
• Hall space group symbol: I 2y
• Residual factor for all reflections: 0.0954
• Residual factor for significantly intense reflections: 0.0489
• Weighted residual factors for significantly intense reflections: 0.094
• Weighted residual factors for all reflections included in the refinement: 0.1101
• Goodness-of-fit parameter for all reflections included in the refinement: 0.994
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No