Information card for entry 7704350

Structure parameters

• Formula: C59 H78 N4 O2 P2 Ti
• Calculated formula: C59 H78 N4 O2 P2 Ti
• 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: 13.449 ± 0.003 Å
• b: 27.82 ± 0.007 Å
• c: 14.86 ± 0.004 Å
• α: 90°
• β: 97.91 ± 0.004°
• γ: 90°
• Cell volume: 5507 ± 2 ų
• Cell temperature: 115 K
• Ambient diffraction temperature: 115 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: 0.1
• Residual factor for significantly intense reflections: 0.056
• Weighted residual factors for significantly intense reflections: 0.1022
• Weighted residual factors for all reflections included in the refinement: 0.1182
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No