Information card for entry 4065796

Structure parameters

• Formula: C88 H180 Mg8 N18 O6 P6
• Calculated formula: C88 H180 Mg8 N18 O6 P6
• Title of publication: Magnesium and Titanium Complexes of Polyanionic Phosphazenate Ligands
• Authors of publication: Boomishankar, Ramamoorthy; Richards, Philip I.; Gupta, Arvind K.; Steiner, Alexander
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 11
• Pages of publication: 2515
• a: 13.52 ± 0.002 Å
• b: 23.536 ± 0.004 Å
• c: 17.87 ± 0.003 Å
• α: 90°
• β: 99.452 ± 0.002°
• γ: 90°
• Cell volume: 5609.2 ± 1.6 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0596
• Residual factor for significantly intense reflections: 0.0461
• Weighted residual factors for significantly intense reflections: 0.1147
• Weighted residual factors for all reflections included in the refinement: 0.1228
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No