Information card for entry 4300176

Structure parameters

• Formula: C42 H36 Cl3.5 Cr3 F6 N12 P
• Calculated formula: C42.004 H32 Cl6.009 Cr3 F6 N12 P
• Title of publication: Linear Trichromium Complexes with Direct Cr to Cr Contacts. 2. Compounds with Cr3(dipyridylamide)43+ Cores
• Authors of publication: Rodolphe Clérac; F. Albert Cotton; Lee M. Daniels; Kim R. Dunbar; Carlos A. Murillo; Isabel Pascual
• Journal of publication: Inorganic Chemistry
• Year of publication: 2000
• Journal volume: 39
• Pages of publication: 752 - 756
• a: 11.545 ± 0.002 Å
• b: 21.426 ± 0.004 Å
• c: 20.238 ± 0.004 Å
• α: 90°
• β: 92.78 ± 0.03°
• γ: 90°
• Cell volume: 5000.2 ± 1.6 ų
• Cell temperature: 213 ± 2 K
• Ambient diffraction temperature: 213 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.137
• Residual factor for significantly intense reflections: 0.0899
• Weighted residual factors for all reflections: 0.268
• Weighted residual factors for significantly intense reflections: 0.2094
• Goodness-of-fit parameter for all reflections: 1.114
• Goodness-of-fit parameter for significantly intense reflections: 1.1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No