Information card for entry 7061544

Structure parameters

• Formula: C7 H23 Cl Co N7 O5
• Calculated formula: C7 H23 Cl Co N7 O5
• Title of publication: Crystalline multicomponent compounds involving hexaammine cobalt(iii) cations
• Authors of publication: Darii, Mariana; Beleaev, Ecaterina S.; Kravtsov, Victor Ch.; Bourosh, Paulina; Chumakov, Yurii; Hauser, Jürg; Decurtins, Silvio; Liu, Shi-Xia; Sultanova, Olga; Baca, Svetlana G.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2022
• Journal volume: 46
• Journal issue: 23
• Pages of publication: 11404 - 11421
• a: 23.3823 ± 0.0009 Å
• b: 6.834 ± 0.0004 Å
• c: 9.4859 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1515.8 ± 0.13 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0518
• Residual factor for significantly intense reflections: 0.0381
• Weighted residual factors for significantly intense reflections: 0.0783
• Weighted residual factors for all reflections included in the refinement: 0.0854
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No