Information card for entry 4311853

Structure parameters

• Formula: C64 H80 N16 O12 S4
• Calculated formula: C64 H80 N16 O12 S4
• Title of publication: Nitric Oxide Reactivity of Fluorophore Coordinated Carboxylate-Bridged Diiron(II) and Dicobalt(II) Complexes
• Authors of publication: Scott A. Hilderbrand; Stephen J. Lippard
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 5294 - 5301
• a: 28.32 ± 0.013 Å
• b: 6.594 ± 0.003 Å
• c: 19.966 ± 0.009 Å
• α: 90°
• β: 117.454 ± 0.007°
• γ: 90°
• Cell volume: 3309 ± 3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0865
• Residual factor for significantly intense reflections: 0.06
• Weighted residual factors for significantly intense reflections: 0.1215
• Weighted residual factors for all reflections included in the refinement: 0.1317
• Goodness-of-fit parameter for all reflections included in the refinement: 1.109
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No