Information card for entry 7117772

Structure parameters

• Formula: C16 H21 Br Co N O4
• Calculated formula: C16 H21 Br Co N O4
• Title of publication: Halomethyl-cobalt(bis-acetylacetonate) for the controlled synthesis of functional polymers
• Authors of publication: Jeremy Demarteau; Anthony Kermagoret; Ian German; Daniela Cordella; Koen Robeyns; Julien De Winter; Pascal Gerbaux; Christine Jerome; Antoine Debuigne; Christophe Detrembleur
• Journal of publication: Chem.Commun.
• Year of publication: 2015
• Journal volume: 51
• Pages of publication: 14334
• a: 8.2934 ± 0.001 Å
• b: 13.814 ± 0.002 Å
• c: 7.8377 ± 0.0011 Å
• α: 90°
• β: 92.388 ± 0.015°
• γ: 90°
• Cell volume: 897.1 ± 0.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 8
• Hermann-Mauguin space group symbol: C 1 m 1
• Hall space group symbol: C -2y
• Residual factor for all reflections: 0.0346
• Residual factor for significantly intense reflections: 0.0334
• Weighted residual factors for significantly intense reflections: 0.0906
• Weighted residual factors for all reflections included in the refinement: 0.0914
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No