Information card for entry 2219300

Structure parameters

• Chemical name: Diaquabis(4-bromobenzoato-κ<i>O</i>)bis(<i>N</i>,<i>N</i>'- diethylnicotinamide-κ<i>N</i>^1^)zinc(II)
• Formula: C34 H40 Br2 N4 O8 Zn
• Calculated formula: C34 H40 Br2 N4 O8 Zn
• Title of publication: Diaquabis(4-bromobenzoato-κ<i>O</i>)bis(<i>N</i>,<i>N</i>'-diethylnicotinamide-κ<i>N</i>^1^)zinc(II)
• Authors of publication: Öztürk, Aslı; Hökelek, Tuncer; Özbek, Fureya Elif; Necefoğlu, Hacali
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 9
• Pages of publication: m1218 - m1219
• a: 7.3761 ± 0.0014 Å
• b: 8.677 ± 0.002 Å
• c: 16.072 ± 0.003 Å
• α: 84.32 ± 0.02°
• β: 78.917 ± 0.017°
• γ: 67.029 ± 0.018°
• Cell volume: 929.1 ± 0.4 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 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: 0.1044
• Residual factor for significantly intense reflections: 0.0581
• Weighted residual factors for significantly intense reflections: 0.1542
• Weighted residual factors for all reflections included in the refinement: 0.177
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes