Information card for entry 7029976

Structure parameters

• Formula: C26 H22 Br2 Cd N2 O5
• Calculated formula: C26 H20 Br2 Cd N2 O5
• Title of publication: Charge-distribution-related regioisomerism of photoresponsive metal-organic polymeric chains.
• Authors of publication: Sun, Jian-Ke; Wang, Peng; Chen, Cheng; Zhou, Xue-Jun; Wu, Li-Ming; Zhang, Yong-Fan; Zhang, Jie
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 43
• Pages of publication: 13441 - 13446
• a: 19.058 ± 0.008 Å
• b: 8.91 ± 0.003 Å
• c: 16.588 ± 0.007 Å
• α: 90°
• β: 121.379 ± 0.004°
• γ: 90°
• Cell volume: 2404.8 ± 1.6 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 6
• 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: 0.0749
• Residual factor for significantly intense reflections: 0.055
• Weighted residual factors for significantly intense reflections: 0.1651
• Weighted residual factors for all reflections included in the refinement: 0.1807
• Goodness-of-fit parameter for all reflections included in the refinement: 1.092
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No