Information card for entry 2219696

Structure parameters

• Chemical name: <i>catena</i>-Poly[[bis(1-ethylimidazole-κN^3^)cobalt(II]-μ-isophthalato- κ^2^<i>O</i>^1^:<i>O</i>^3^]
• Formula: C18 H20 Co N4 O4
• Calculated formula: C18 H20 Co N4 O4
• SMILES: [Co](OC(=O)c1cccc(c1)C(=O)[O-])([n]1cn(CC)cc1)([n]1ccn(CC)c1)OC(=O)c1cc(ccc1)C(=O)O[Co]([n]1cn(CC)cc1)[n]1ccn(CC)c1
• Title of publication: <i>catena</i>-Poly[[bis(1-ethylimidazole-κ<i>N</i>^3^)cobalt(II)]-μ-isophthalato-κ^2^<i>O</i>^1^:<i>O</i>^3^]
• Authors of publication: Zhao, Juan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 10
• Pages of publication: m1334
• a: 15.174 ± 0.003 Å
• b: 9.665 ± 0.0019 Å
• c: 13.183 ± 0.003 Å
• α: 90°
• β: 104.63 ± 0.03°
• γ: 90°
• Cell volume: 1870.7 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.0719
• Residual factor for significantly intense reflections: 0.0569
• Weighted residual factors for significantly intense reflections: 0.137
• Weighted residual factors for all reflections included in the refinement: 0.1517
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes