Information card for entry 7704353

Structure parameters

• Formula: C66 H82 Cl4 N2 O4 P2 Zr
• Calculated formula: C66 H82 Cl4 N2 O4 P2 Zr
• Title of publication: Phosphasalen group IV metal complexes: synthesis, characterization and ring opening polymerization of lactide.
• Authors of publication: Normand, Adrien T.; Malacea-Kabbara, Raluca; Lapenta, Rosita; Dajnak, Aymeric; Richard, Philippe; Cattey, Hélène; Bolley, Anaëlle; Grassi, Alfonso; Milione, Stefano; Auffrant, Audrey; Dagorne, Samuel; Le Gendre, Pierre
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 21
• Pages of publication: 6989 - 7004
• a: 13.3206 ± 0.0009 Å
• b: 13.3221 ± 0.0008 Å
• c: 22.2555 ± 0.0013 Å
• α: 104.471 ± 0.003°
• β: 102.628 ± 0.003°
• γ: 101.728 ± 0.003°
• Cell volume: 3589.9 ± 0.4 ų
• Cell temperature: 115 K
• Ambient diffraction temperature: 115 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1175
• Residual factor for significantly intense reflections: 0.088
• Weighted residual factors for significantly intense reflections: 0.2468
• Weighted residual factors for all reflections included in the refinement: 0.2619
• Goodness-of-fit parameter for all reflections included in the refinement: 1.179
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No