Information card for entry 7704501

Structure parameters

• Chemical name: PNN2Co3NO26
• Formula: C48 H61 Co3 N13 O12 P2
• Calculated formula: C48 H61 Co3 N13 O12 P2
• Title of publication: Nitrogen oxyanion reduction by Co(ii) augmented by a proton responsive ligand: recruiting multiple metals.
• Authors of publication: Cabelof, Alyssa C.; Carta, Veronica; Chen, Chun-Hsing; Caulton, Kenneth G.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 23
• Pages of publication: 7891 - 7896
• a: 17.0816 ± 0.00003 Å
• b: 21.4257 ± 0.00003 Å
• c: 16.5137 ± 0.00003 Å
• α: 90°
• β: 104.073 ± 0.003°
• γ: 90°
• Cell volume: 5862.38 ± 0.08 ų
• Cell temperature: 153 K
• Ambient diffraction temperature: 153 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: 0.0808
• Residual factor for significantly intense reflections: 0.049
• Weighted residual factors for all reflections: 0.1633
• Weighted residual factors for significantly intense reflections: 0.1322
• Weighted residual factors for all reflections included in the refinement: 0.1564
• Goodness-of-fit parameter for all reflections included in the refinement: 0.8051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No