Information card for entry 2241707

Structure parameters

• Chemical name: Diaquabis(4-<i>tert</i>-butylbenzoato-κ<i>O</i>)bis(nicotinamide-κ<i>N</i>^1^)cobalt(II) dihydrate
• Formula: C34 H46 Co N4 O10
• Calculated formula: C34 H46 Co N4 O10
• Title of publication: Crystal structure of diaquabis(4-<i>tert</i>-butylbenzoato-κ<i>O</i>)bis(nicotinamide-κ<i>N</i>^1^)cobalt(II) dihydrate
• Authors of publication: Aşkın, Gülçin Şefiye; Necefoğlu, Hacali; Özkaya, Safiye; Çatak Çelik, Raziye; Hökelek, Tuncer
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2016
• Journal volume: 72
• Journal issue: 7
• Pages of publication: 888 - 891
• a: 7.9608 ± 0.0005 Å
• b: 10.0679 ± 0.0006 Å
• c: 12.3007 ± 0.0007 Å
• α: 72.087 ± 0.002°
• β: 74.841 ± 0.003°
• γ: 78.66 ± 0.003°
• Cell volume: 898.17 ± 0.09 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: 0.0384
• Residual factor for significantly intense reflections: 0.0358
• Weighted residual factors for significantly intense reflections: 0.0982
• Weighted residual factors for all reflections included in the refinement: 0.1014
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes