Information card for entry 7112092

Structure parameters

• Formula: C30 H20 N4 O13 Zn2
• Calculated formula: C30 H20 N4 O13 Zn2
• Title of publication: Single-crystal-to-single-crystal transformation of a two-dimensional coordination polymer through highly selective [2+2] photodimerization of a conjugated dialkene
• Authors of publication: Dong Liu; Hui-Fang Wang; Brendan F. Abrahams; Jian-Ping Lang
• Journal of publication: Chem.Commun.
• Year of publication: 2014
• Journal volume: 50
• Pages of publication: 3173
• a: 10.905 ± 0.002 Å
• b: 12.399 ± 0.003 Å
• c: 11.809 ± 0.002 Å
• α: 79.53 ± 0.03°
• β: 74.15 ± 0.03°
• γ: 89.19 ± 0.03°
• Cell volume: 1509.4 ± 0.6 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0372
• Residual factor for significantly intense reflections: 0.033
• Weighted residual factors for significantly intense reflections: 0.0999
• Weighted residual factors for all reflections included in the refinement: 0.1036
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No