Information card for entry 4327151

Structure parameters

• Formula: C63 H87 Cl2 Fe2 Gd2 N15 O27
• Calculated formula: C63 H87 Cl2 Fe2 Gd2 N15 O27
• Title of publication: Salen-Based Coordination Polymers of Iron and the Rare Earth Elements
• Authors of publication: Asamanjoy Bhunia; Yanhua Lan; Valeriu Mereacre; Michael T. Gamer; Annie K. Powell; Peter W. Roesky
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 12697 - 12704
• a: 13.614 ± 0.003 Å
• b: 14.83 ± 0.003 Å
• c: 21.566 ± 0.004 Å
• α: 87.37 ± 0.03°
• β: 74.37 ± 0.03°
• γ: 76.58 ± 0.03°
• Cell volume: 4077.9 ± 1.6 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0713
• Residual factor for significantly intense reflections: 0.0505
• Weighted residual factors for significantly intense reflections: 0.1235
• Weighted residual factors for all reflections included in the refinement: 0.1321
• Goodness-of-fit parameter for all reflections included in the refinement: 0.947
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No