Information card for entry 7134467

Structure parameters

• Formula: C28 H46 O2 P2 Si
• Calculated formula: C28 H46 O2 P2 Si
• Title of publication: PCP and POCOP complexes of calcium
• Authors of publication: Messori, Alessandro; Potocnik, Marcel; Belazregue, Sara; Collins, Richard; Krämer, Tobias; Chadwick, F. Mark
• Journal of publication: Chemical Communications
• Year of publication: 2025
• Journal volume: 61
• Journal issue: 43
• Pages of publication: 7827 - 7830
• a: 11.4317 ± 0.0002 Å
• b: 19.1095 ± 0.0002 Å
• c: 14.6851 ± 0.0002 Å
• α: 90°
• β: 106.607 ± 0.0015°
• γ: 90°
• Cell volume: 3074.21 ± 0.08 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 5
• 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: 0.0476
• Residual factor for significantly intense reflections: 0.0395
• Weighted residual factors for all reflections: 0.1185
• Weighted residual factors for significantly intense reflections: 0.1089
• Weighted residual factors for all reflections included in the refinement: 0.1127
• Goodness-of-fit parameter for all reflections included in the refinement: 0.9631
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No