Information card for entry 4501890

Structure parameters

• Formula: C12 H6 Cd O4
• Calculated formula: C12 H6 Cd O4
• Title of publication: Regulation and Properties of Diversiform Cd(II) Supramolecular Complexes with a Bulky Naphthalene-Based Dicarboxyl Tecton and DifferentN-Donor Co-Ligands
• Authors of publication: Fang, Shao-Ming; Zhang, Qiang; Hu, Min; Yang, Xiao-Gang; Zhou, Li-Ming; Du, Miao; Liu, Chun-Sen
• Journal of publication: Crystal Growth & Design
• Year of publication: 2010
• Journal volume: 10
• Journal issue: 11
• Pages of publication: 4773
• a: 18.942 ± 0.002 Å
• b: 7.3043 ± 0.0009 Å
• c: 7.1343 ± 0.0006 Å
• α: 90°
• β: 94.013 ± 0.009°
• γ: 90°
• Cell volume: 984.67 ± 0.18 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 4
• 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: 0.0501
• Residual factor for significantly intense reflections: 0.0274
• Weighted residual factors for significantly intense reflections: 0.0349
• Weighted residual factors for all reflections included in the refinement: 0.0361
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No