Information card for entry 4323678

Structure parameters

• Common name: compound 1*(BPh4)2
• Formula: C67 H59 B Cl Co N0 O0.5 P3
• Calculated formula: C134 H118 B2 Cl2 Co2 O P6
• Title of publication: Complexes of Cobalt(II) Chloride with the Tripodal Trisphosphane triphos: Solution Dynamics, Spin-Crossover, Reactivity, and Redox Activity
• Authors of publication: Katja Heinze; Gottfried Huttner; Laszlo Zsolnai; Peter Schober
• Journal of publication: Inorganic Chemistry
• Year of publication: 1997
• Journal volume: 36
• Pages of publication: 5457 - 5469
• a: 23.808 ± 0.003 Å
• b: 16.544 ± 0.004 Å
• c: 30.26 ± 0.004 Å
• α: 90°
• β: 76.94 ± 0.01°
• γ: 90°
• Cell volume: 11611 ± 4 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 K
• Number of distinct elements: 8
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1063
• Residual factor for significantly intense reflections: 0.0647
• Weighted residual factors for all reflections: 0.2022
• Weighted residual factors for significantly intense reflections: 0.1728
• Goodness-of-fit parameter for all reflections: 1.218
• Goodness-of-fit parameter for significantly intense reflections: 1.278
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No