Information card for entry 7704346

Structure parameters

• Formula: C68 H78 N2 O2 P2 Zr
• Calculated formula: C68 H78 N2 O2 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: 18.8787 ± 0.0011 Å
• b: 15.7181 ± 0.0009 Å
• c: 27.6141 ± 0.0015 Å
• α: 90°
• β: 105.651 ± 0.001°
• γ: 90°
• Cell volume: 7890.3 ± 0.8 ų
• Cell temperature: 110 K
• Ambient diffraction temperature: 110 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0659
• Residual factor for significantly intense reflections: 0.0514
• Weighted residual factors for significantly intense reflections: 0.139
• Weighted residual factors for all reflections included in the refinement: 0.1497
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No