Information card for entry 4314347

Structure parameters

• Formula: C2 H9 Cl Cr N O4 P
• Calculated formula: C2 H7 Cl Cr N O4 P
• Title of publication: Cr[(H3N-(CH2)2-PO3)(Cl)(H2O)]: X-Ray Single-Crystal Structure and Magnetism of a Polar Organic-Inorganic Hybrid Chromium(II) Organophosphonate
• Authors of publication: Elvira M. Bauer; Carlo Bellitto; Marcello Colapietro; Gustavo Portalone; Guido Righini
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 6345 - 6351
• a: 5.249 ± 0.001 Å
• b: 14.133 ± 0.003 Å
• c: 5.275 ± 0.001 Å
• α: 90°
• β: 105.55 ± 0.02°
• γ: 90°
• Cell volume: 377 ± 0.13 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 7
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.024
• Residual factor for significantly intense reflections: 0.024
• Weighted residual factors for all reflections: 0.035
• Weighted residual factors for significantly intense reflections: 0.035
• Weighted residual factors for all reflections included in the refinement: 0.035
• Goodness-of-fit parameter for all reflections: 0.84
• Goodness-of-fit parameter for significantly intense reflections: 0.84
• Goodness-of-fit parameter for all reflections included in the refinement: 0.84
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No