Information card for entry 7058268

Structure parameters

• Formula: C70 H54 Co2 N12 O2 P2
• Calculated formula: C70 H50 Co2 N12 O2 P2
• Title of publication: A novel octacyanido dicobalt(iii) building block for the construction of heterometallic compounds
• Authors of publication: Alexandru, Maria-Gabriela; Marino, Nadia; Visinescu, Diana; De Munno, Giovanni; Andruh, Marius; Bentama, Abdeslem; Lloret, Francesc; Julve, Miguel
• Journal of publication: New Journal of Chemistry
• Year of publication: 2019
• Journal volume: 43
• Journal issue: 17
• Pages of publication: 6675
• a: 9.0615 ± 0.0002 Å
• b: 25.7607 ± 0.0005 Å
• c: 13.9161 ± 0.0003 Å
• α: 90°
• β: 105.672 ± 0.001°
• γ: 90°
• Cell volume: 3127.68 ± 0.12 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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: 0.0504
• Residual factor for significantly intense reflections: 0.038
• Weighted residual factors for significantly intense reflections: 0.087
• Weighted residual factors for all reflections included in the refinement: 0.0936
• Goodness-of-fit parameter for all reflections included in the refinement: 1.078
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No