Information card for entry 2019527

Structure parameters

• Chemical name: Poly[[μ~3~-2,2'-(disulfanediyl)dibenzoato-κ^5^<i>O</i>,<i>O</i>':<i>O</i>:<i>O</i>'',<i>O</i>'''](1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cadmium(II)]
• Formula: C26 H16 Cd N2 O4 S2
• Calculated formula: C26 H16 Cd N2 O4 S2
• Title of publication: A two-dimensional Cd^II^ coordination polymer with 2,2'-(disulfanediyl)dibenzoate and 1,10-phenanthroline ligands
• Authors of publication: Jin, Yu-Xiu; Yang, Fang; Yuan, Li-Min; Yan, Chao-Guo; Liu, Wen-Long
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 5
• Pages of publication: 517 - 521
• a: 12.2769 ± 0.0018 Å
• b: 12.4664 ± 0.0018 Å
• c: 16.5885 ± 0.0017 Å
• α: 90°
• β: 116.011 ± 0.008°
• γ: 90°
• Cell volume: 2281.7 ± 0.5 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0772
• Residual factor for significantly intense reflections: 0.0395
• Weighted residual factors for significantly intense reflections: 0.0678
• Weighted residual factors for all reflections included in the refinement: 0.079
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes