Information card for entry 2238238

Structure parameters

• Chemical name: <i>cis</i>-Bromido(methylamine)bis(propane-1,3-diamine)cobalt(III) dibromide
• Formula: C7 H25 Br3 Co N5
• Calculated formula: C7 H25 Br3 Co N5
• SMILES: C1CC[NH2][Co]2([NH2]1)([NH2]CCC[NH2]2)([NH2]C)Br.[Br-].[Br-]
• Title of publication: <i>cis</i>-Bromido(methylamine)bis(propane-1,3-diamine)cobalt(III) dibromide
• Authors of publication: Kannan, P. S.; Ganeshraja, A. S.; Anbalagan, K.; Govindan, E.; SubbiahPandi, A.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 7
• Pages of publication: m374 - m375
• a: 13.4418 ± 0.0002 Å
• b: 8.3088 ± 0.0001 Å
• c: 15.1538 ± 0.0002 Å
• α: 90°
• β: 110.61 ± 0.02°
• γ: 90°
• Cell volume: 1584.1 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1178
• Residual factor for significantly intense reflections: 0.0726
• Weighted residual factors for significantly intense reflections: 0.2171
• Weighted residual factors for all reflections included in the refinement: 0.2377
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes