Information card for entry 4307858

Structure parameters

• Formula: C104 H132 Cu10 N16 O128 Rb4 Si2 W22
• Calculated formula: C104 H64 Cu10 N16 O128 Rb4 Si2 W22
• Title of publication: Coexistence of Five Different Copper(II)-Phenanthroline Species in the Crystal Packing of Inorganic-Metalorganic Hybrids Based on Keggin Polyoxometalates and Copper(II)-Phenanthroline-Oxalate Complexes
• Authors of publication: Santiago Reinoso; Pablo Vitoria; Juan M. Gutiérrez-Zorrilla; Luis Lezama; Juan M. Madariaga; Leire San Felices; Amaia Iturrospe
• Journal of publication: Inorganic Chemistry
• Year of publication: 2007
• Journal volume: 46
• Pages of publication: 4010 - 4021
• a: 13.1674 ± 0.0002 Å
• b: 16.9263 ± 0.0004 Å
• c: 22.9728 ± 0.0006 Å
• α: 71.073 ± 0.002°
• β: 86.908 ± 0.002°
• γ: 71.451 ± 0.002°
• Cell volume: 4584.72 ± 0.19 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0797
• Residual factor for significantly intense reflections: 0.0513
• Weighted residual factors for significantly intense reflections: 0.1469
• Weighted residual factors for all reflections included in the refinement: 0.1541
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No