Information card for entry 4507814

Structure parameters

• Formula: C18 H19 Cu N2 O9 P2 V
• Calculated formula: C18 H18 Cu N2 O8.54 P2 V
• Title of publication: Hydrothermal Synthesis and Structural Characterization of Metal Organophosphonate Oxide Materials: Role of Metal-Oxo Clusters in the Self Assembly of Metal Phosphonate Architectures
• Authors of publication: Tripuramallu, Bharat Kumar; Das, Samar K.
• Journal of publication: Crystal Growth & Design
• Year of publication: 2013
• Journal volume: 13
• Journal issue: 6
• Pages of publication: 2426
• a: 8.006 ± 0.0007 Å
• b: 10.6191 ± 0.0009 Å
• c: 12.5398 ± 0.0011 Å
• α: 83.594 ± 0.001°
• β: 75.425 ± 0.001°
• γ: 88.442 ± 0.001°
• Cell volume: 1025.34 ± 0.15 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.0377
• Residual factor for significantly intense reflections: 0.0339
• Weighted residual factors for significantly intense reflections: 0.0884
• Weighted residual factors for all reflections included in the refinement: 0.0916
• Goodness-of-fit parameter for all reflections included in the refinement: 0.853
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No