Information card for entry 7103828

Structure parameters

• Formula: C34 H65 B4 F16 N9 Ni6 S8
• Calculated formula: C34 H64 B4 F16 N9 Ni6 S8
• Title of publication: Pinwheel motifs: formation of unusual homo- and hetero-nuclear aggregates via bridging thiolates
• Authors of publication: Amoroso, Angelo J.; Chung, Simon S. M.; Spencer, Douglas J. E.; Danks, Jonathan P.; Glenny, Mark W.; Blake, Alexander J.; Cooke, Paul A.; Wilson, Claire; Schröder, Martin
• Journal of publication: Chemical Communications (Cambridge, United Kingdom)
• Year of publication: 2003
• Journal issue: 16
• Pages of publication: 2020 - 2021
• a: 25.796 ± 0.005 Å
• b: 25.796 ± 0.005 Å
• c: 25.796 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 17166 ± 6 ų
• Cell temperature: 220 ± 2 K
• Ambient diffraction temperature: 220 ± 2 K
• Number of distinct elements: 7
• Space group number: 211
• Hermann-Mauguin space group symbol: I 4 3 2
• Hall space group symbol: I 4 2 3
• Residual factor for all reflections: 0.103
• Residual factor for significantly intense reflections: 0.066
• Weighted residual factors for significantly intense reflections: 0.113
• Weighted residual factors for all reflections included in the refinement: 0.129
• Goodness-of-fit parameter for all reflections included in the refinement: 1.13
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No