Information card for entry 7043992

Structure parameters

• Formula: C95 H104 N12 Zn2
• Calculated formula: C95 H104 N12 Zn2
• Title of publication: New homoleptic bis(pyrrolylpyridiylimino) Mg(II) and Zn(II) complexes as catalysts for the ring opening polymerization of cyclic esters via an "activated monomer" mechanism.
• Authors of publication: D'Auria, Ilaria; Tedesco, Consiglia; MAZZEO, Mina; Pellecchia, Claudio
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 20.124 ± 0.003 Å
• b: 19.606 ± 0.003 Å
• c: 21.718 ± 0.003 Å
• α: 90°
• β: 94.445 ± 0.004°
• γ: 90°
• Cell volume: 8543 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• 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: 0.2163
• Residual factor for significantly intense reflections: 0.0968
• Weighted residual factors for significantly intense reflections: 0.2412
• Weighted residual factors for all reflections included in the refinement: 0.3286
• Goodness-of-fit parameter for all reflections included in the refinement: 0.999
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No