Information card for entry 7106138

Structure parameters

• Formula: C86 H100 N8 O6 Zn2
• Calculated formula: C86 H100 N8 O6 Zn2
• Title of publication: Controlled structures of a 1D chiral metallosalen polymer by photo- and solvent-induced partial depolymerization
• Authors of publication: Xiaobing Xi; Taiwei Dong; Gao Li; Yong Cui
• Journal of publication: Chem.Commun.
• Year of publication: 2011
• Journal volume: 47
• Pages of publication: 3831
• a: 17.428 ± 0.004 Å
• b: 13.517 ± 0.003 Å
• c: 17.588 ± 0.004 Å
• α: 90°
• β: 100.24 ± 0.03°
• γ: 90°
• Cell volume: 4077.3 ± 1.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.1286
• Residual factor for significantly intense reflections: 0.072
• Weighted residual factors for significantly intense reflections: 0.1859
• Weighted residual factors for all reflections included in the refinement: 0.2292
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No