Information card for entry 7125328

Structure parameters

• Chemical name: Co(PTB)2Br2
• Formula: C144 H168 B4 Br4 Co3 N6 O6 P4
• Calculated formula: C144 H168 B4 Br4 Co3 N6 O6 P4
• Title of publication: Fusing triphenylphosphine with tetraphenylborate: introducing the 9-phosphatriptycene-10-phenylborate (PTB) anion.
• Authors of publication: Drover, Marcus W.; Nagata, Koichi; Peters, Jonas C.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2018
• Journal volume: 54
• Journal issue: 57
• Pages of publication: 7916 - 7919
• a: 22.776 ± 0.002 Å
• b: 11.6346 ± 0.0012 Å
• c: 27.261 ± 0.003 Å
• α: 90°
• β: 113.332 ± 0.003°
• γ: 90°
• Cell volume: 6633.2 ± 1.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• 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: 0.0946
• Residual factor for significantly intense reflections: 0.061
• Weighted residual factors for significantly intense reflections: 0.1377
• Weighted residual factors for all reflections included in the refinement: 0.1536
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No