Information card for entry 8103150

Structure parameters

• Formula: C30 H30 Cl Co N3 O8
• Calculated formula: C30 H27 Cl Co N3 O8
• Title of publication: Crystal structure of [3-(N-methyl-2-pyridyl-N-hydroxy-methyl-2-pyridyl)aminopropionic acid-?4N,N',N'',O]-(flavonolato-?2O,O')cobalt(III) chloride — water (1:2), [Co(C15H17N3O3)(C15H9O3)]Cl · 2H2O
• Authors of publication: Gábor Baráth; Gergely Rácz; Gábor Speier; József Sándor Pap; József Kaizer; Michel Giorgi
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2011
• Journal volume: 226
• Journal issue: 3
• Pages of publication: 414
• a: 8.1874 ± 0.0003 Å
• b: 12.2733 ± 0.0003 Å
• c: 16.6712 ± 0.0006 Å
• α: 98.341 ± 0.001°
• β: 100.289 ± 0.001°
• γ: 104.827 ± 0.003°
• Cell volume: 1561.03 ± 0.09 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.1388
• Residual factor for significantly intense reflections: 0.0892
• Weighted residual factors for significantly intense reflections: 0.2223
• Weighted residual factors for all reflections included in the refinement: 0.2629
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No