Information card for entry 7704227

Structure parameters

• Formula: C75 H111 Al2 Cl2 N4 O4
• Calculated formula: C75 H111 Al2 Cl2 N4 O4
• Title of publication: Copolymerization of CHO/CO₂ catalyzed by a series of aluminum amino-phenolate complexes and insights into structure-activity relationships.
• Authors of publication: Plommer, Hart; Stein, Laura; Murphy, Jennifer N.; Ikpo, Nduka; Mora-Diez, Nelaine; Kerton, Francesca M.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 20
• Pages of publication: 6884 - 6895
• a: 7.775 ± 0.0002 Å
• b: 11.1513 ± 0.0003 Å
• c: 21.4322 ± 0.0005 Å
• α: 75.708 ± 0.002°
• β: 89.494 ± 0.002°
• γ: 74.48 ± 0.002°
• Cell volume: 1731.77 ± 0.08 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0675
• Residual factor for significantly intense reflections: 0.0598
• Weighted residual factors for significantly intense reflections: 0.1499
• Weighted residual factors for all reflections included in the refinement: 0.1563
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No