Information card for entry 2213402

Structure parameters

• Chemical name: Bis(2-chlorobenzoato-κO)bis(phenazone-κO)zinc(II) 0.612-hydrate
• Formula: C36 H33.22 Cl2 N4 O6.61 Zn
• Calculated formula: C36 H33.224 Cl2 N4 O6.612 Zn
• Title of publication: Bis(2-chlorobenzoato-κ<i>O</i>)bis(phenazone-κ<i>O</i>)zinc(II) 0.612-hydrate
• Authors of publication: Maroszová, Jaroslava; Findoráková, Lenka; Györyvá, Katarína; Koman, Marian; Melník, Milan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 5
• Pages of publication: m1406 - m1407
• a: 27.986 ± 0.003 Å
• b: 9.6403 ± 0.0012 Å
• c: 14.513 ± 0.004 Å
• α: 90°
• β: 111.746 ± 0.011°
• γ: 90°
• Cell volume: 3636.9 ± 1.2 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1505
• Residual factor for significantly intense reflections: 0.0641
• Weighted residual factors for significantly intense reflections: 0.1115
• Weighted residual factors for all reflections included in the refinement: 0.1382
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes