Information card for entry 4304169

Structure parameters

• Formula: C24 H26 N4 O14 Zn
• Calculated formula: C24 H26 N4 O14 Zn
• SMILES: C(=O)(c1ccc(cc1)N(=O)=O)O[Zn]([O]=n1ccccc1)([OH2])(OC(=O)c1ccc(cc1)N(=O)=O)([O]=n1ccccc1)[OH2].O.O
• Title of publication: N-Oxides in Metal-Containing Multicomponent Molecular Complexes
• Authors of publication: Rupam Sarma; Anirban Karmakar; Jubaraj B. Baruah
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 763 - 765
• a: 7.1072 ± 0.0001 Å
• b: 7.1988 ± 0.0001 Å
• c: 15.0684 ± 0.0003 Å
• α: 95.819 ± 0.002°
• β: 91.21 ± 0.001°
• γ: 116.162 ± 0.001°
• Cell volume: 686.53 ± 0.02 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.026
• Residual factor for significantly intense reflections: 0.0247
• Weighted residual factors for significantly intense reflections: 0.0712
• Weighted residual factors for all reflections included in the refinement: 0.0721
• Goodness-of-fit parameter for all reflections included in the refinement: 1.093
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No