Information card for entry 7014478

Structure parameters

• Formula: C59.75 H57.5 Cl3.5 Cr F20 N3
• Calculated formula: C59.75 H57.5 Cl3.5 Cr F20 N3
• Title of publication: Synthesis, characterisation and magnetic properties of octahedral chromium(III) compounds with six C-donor ligands.
• Authors of publication: Alonso, Pablo J.; Arauzo, Ana B.; García-Monforte, M Angeles; García-Rubio, Inés; Martín, Antonio; Menjón, Babil; Rillo, Conrado
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 4
• Pages of publication: 853 - 861
• a: 11.969 ± 0.0002 Å
• b: 14.2368 ± 0.0002 Å
• c: 18.3719 ± 0.0003 Å
• α: 88.589 ± 0.001°
• β: 87.877 ± 0.001°
• γ: 88.956 ± 0.001°
• Cell volume: 3127.01 ± 0.09 ų
• Cell temperature: 100 ± 1 K
• Ambient diffraction temperature: 100 ± 1 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: 0.1184
• Residual factor for significantly intense reflections: 0.0954
• Weighted residual factors for significantly intense reflections: 0.3208
• Weighted residual factors for all reflections included in the refinement: 0.3389
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No