Information card for entry 7106770

Structure parameters

• Formula: C29 H22 N2 O9 Zn2
• Calculated formula: C29 H22 N2 O9 Zn2
• Title of publication: Solvochromic and photodimerization behaviour of 1D coordination polymer via single-crystal-to-single-crystal transformation
• Authors of publication: Ou, Yong-Cong; Liu, Wen-Ting; Li, Jin-Yan; Zhang, Gong-Guo; Wang, Jing; Tong, Ming-Liang
• Journal of publication: Chemical Communications (Cambridge, United Kingdom)
• Year of publication: 2011
• Journal volume: 47
• Journal issue: 33
• Pages of publication: 9384 - 9386
• a: 7.4121 ± 0.0003 Å
• b: 10.3132 ± 0.0005 Å
• c: 17.9686 ± 0.0009 Å
• α: 87.702 ± 0.004°
• β: 78.851 ± 0.004°
• γ: 70.945 ± 0.004°
• Cell volume: 1273.41 ± 0.11 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.048
• Residual factor for significantly intense reflections: 0.0337
• Weighted residual factors for significantly intense reflections: 0.0806
• Weighted residual factors for all reflections included in the refinement: 0.0846
• Goodness-of-fit parameter for all reflections included in the refinement: 0.942
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No