Information card for entry 7062677

Structure parameters

• Formula: C54 H64 Cl Co4 N15 O18
• Calculated formula: C52 H56 Cl Co4 N15 O16
• SMILES: [Co]1234([NH]5Cc6cccc7[O]([Co]8(N=N#N)([O]2c67)([O]3c2c(C[NH]1CCC5)cccc2[O]8C)[O]=C(O4)c1ccc(N(=O)=O)cc1)C)N=N#N.[Co]1234([NH]5Cc6cccc7[O]([Co]8([O]2c67)([O]3c2c(C[NH]1CCC5)cccc2[O]8C)([O]=C(O4)c1ccc(N(=O)=O)cc1)Cl)C)N=N#N
• Title of publication: Slow relaxation of the magnetization in two cobalt(iii)/cobalt(ii) dimers
• Authors of publication: Sarkar, Rabi Sankar; Gómez-García, Carlos J.; Drew, Michael G. B.; Chattopadhyay, Shouvik
• Journal of publication: New Journal of Chemistry
• Year of publication: 2023
• Journal volume: 47
• Journal issue: 36
• Pages of publication: 16913 - 16926
• a: 10.671 ± 0.009 Å
• b: 16.864 ± 0.014 Å
• c: 19.112 ± 0.015 Å
• α: 111.862 ± 0.012°
• β: 91.69 ± 0.02°
• γ: 90.834 ± 0.015°
• Cell volume: 3189 ± 5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1022
• Residual factor for significantly intense reflections: 0.0741
• Weighted residual factors for significantly intense reflections: 0.1421
• Weighted residual factors for all reflections included in the refinement: 0.1544
• Goodness-of-fit parameter for all reflections included in the refinement: 1.14
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No