Information card for entry 7710408

Structure parameters

• Formula: C H12 Cd N3 O6 P3
• Calculated formula: C H12 Cd N3 O6 P3
• Title of publication: Structural, magnetic and photoluminescence properties of new hybrid hypophosphites: discovery of the first noncentrosymmetric and two cobalt-based members
• Authors of publication: Mączka, Mirosław; Gągor, Anna; Stefańska, Dagmara; Zaręba, Jan K.; Pikul, Adam
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 9.25 ± 0.0002 Å
• b: 9.25 ± 0.0002 Å
• c: 23.0532 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 1708.23 ± 0.07 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 167
• Hermann-Mauguin space group symbol: R -3 c :H
• Hall space group symbol: -R 3 2"c
• Residual factor for all reflections: 0.0199
• Residual factor for significantly intense reflections: 0.0184
• Weighted residual factors for significantly intense reflections: 0.0441
• Weighted residual factors for all reflections included in the refinement: 0.045
• Goodness-of-fit parameter for all reflections included in the refinement: 1.076
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No