Information card for entry 8104613

Structure parameters

• Formula: C18 H22 Cd O12
• Calculated formula: C18 H22 Cd O12
• Title of publication: Crystal structure of tetraaqua-(2-(4-formylphenoxy)acetato-k1 O)cadmium(II), C18H22O12Cd
• Authors of publication: Tai, Xi-Shi; Wang, Li-Hua
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2021
• Journal volume: 236
• Journal issue: 6
• Pages of publication: 1379 - 1380
• a: 13.3069 ± 0.0009 Å
• b: 9.9041 ± 0.0006 Å
• c: 8.158 ± 0.0005 Å
• α: 90°
• β: 106.374 ± 0.007°
• γ: 90°
• Cell volume: 1031.56 ± 0.12 ų
• Cell temperature: 200 ± 0.1 K
• Ambient diffraction temperature: 200 ± 0.1 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0262
• Residual factor for significantly intense reflections: 0.0216
• Weighted residual factors for significantly intense reflections: 0.0492
• Weighted residual factors for all reflections included in the refinement: 0.0522
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No