Information card for entry 7707711

Structure parameters

• Formula: C84 H164 Co4 N2 O44 Tb4
• Calculated formula: C84 H160 Co4 N2 O44 Tb4
• Title of publication: Solvent-induced structural transformation from heptanuclear to decanuclear [Co-Ln] coordination clusters: trapping of unique counteranion and understanding of aggregation pathways.
• Authors of publication: Basak, Dipmalya; Martí, Emma Regincós; Murrie, Mark; Nemec, Ivan; Ray, Debashis
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• Journal volume: 50
• Journal issue: 27
• Pages of publication: 9574 - 9588
• a: 19.1693 ± 0.0009 Å
• b: 12.4008 ± 0.0007 Å
• c: 27.0683 ± 0.0013 Å
• α: 90°
• β: 107.573 ± 0.003°
• γ: 90°
• Cell volume: 6134.3 ± 0.5 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/n 1
• Hall space group symbol: -P 2yac
• Residual factor for all reflections: 0.078
• Residual factor for significantly intense reflections: 0.0502
• Weighted residual factors for significantly intense reflections: 0.1252
• Weighted residual factors for all reflections included in the refinement: 0.151
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No