Information card for entry 7208915

Structure parameters

• Formula: C15 H18 Cd N2 O9 S2
• Calculated formula: C15 H16 Cd N2 O9 S2
• Title of publication: Synthetic methods and structural study of coordination polymers of Cd(ii) and Co(ii) with tetrathiafulvalene‒tetracarboxylate
• Authors of publication: Shao, Ming-Yan; Huo, Peng; Sun, Yong-Gang; Li, Xin-Yu; Zhu, Qin-Yu; Dai, Jie
• Journal of publication: CrystEngComm
• Year of publication: 2013
• Journal volume: 15
• Journal issue: 6
• Pages of publication: 1086
• a: 8.7258 ± 0.0011 Å
• b: 10.6743 ± 0.0006 Å
• c: 11.7457 ± 0.0011 Å
• α: 65.623 ± 0.012°
• β: 78.885 ± 0.014°
• γ: 76.553 ± 0.014°
• Cell volume: 963.36 ± 0.19 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.068
• Residual factor for significantly intense reflections: 0.0496
• Weighted residual factors for significantly intense reflections: 0.0997
• Weighted residual factors for all reflections included in the refinement: 0.1083
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No