Information card for entry 7200537

Structure parameters

• Formula: C38 H27 Cl N4 O10 Zn
• Calculated formula: C38 H26 Cl N4 O10 Zn
• SMILES: [Zn]123([O]=C(COc4cc5ccccc5cc4OCC(=O)O)O3)([n]3cccc4ccc5ccc[n]1c5c34)[n]1cccc3ccc4ccc[n]2c4c13.Cl(=O)(=O)(=O)[O-]
• Title of publication: Zinc(II) and cobalt(II) complexes of (3-carboxymethoxy-naphthalen-2-yloxy)-acetic acid: a structural study
• Authors of publication: Karmakar, Anirban; Baruah, Jubaraj B.; Boomi Shankar, R.
• Journal of publication: CrystEngComm
• Year of publication: 2009
• Journal volume: 11
• Journal issue: 5
• Pages of publication: 832
• a: 11.983 ± 0.003 Å
• b: 12.683 ± 0.003 Å
• c: 13.089 ± 0.004 Å
• α: 75.057 ± 0.01°
• β: 89.597 ± 0.011°
• γ: 71.714 ± 0.01°
• Cell volume: 1819 ± 0.9 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.1149
• Residual factor for significantly intense reflections: 0.0863
• Weighted residual factors for significantly intense reflections: 0.28
• Weighted residual factors for all reflections included in the refinement: 0.3065
• Goodness-of-fit parameter for all reflections included in the refinement: 1.141
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No