Information card for entry 7103830

Structure parameters

• Common name: Tris-Nickel 3,7-dithianonane-1,9-dithiolate bis-copper hexaflurophosphate
• Chemical name: Tris-Nickel 3,7-dithianonane-1,9-dithiolate bis-copper hexaflurophosphate
• Formula: C17 H34 Cu2 F12 Ni3 P2 S12
• Calculated formula: C17.975 H30.45 Cu2 F12 Ni3 P2 S12
• 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: 17.466 ± 0.003 Å
• b: 22.546 ± 0.007 Å
• c: 12.156 ± 0.007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4787 ± 3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• 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: 0.187
• Residual factor for significantly intense reflections: 0.127
• Weighted residual factors for significantly intense reflections: 0.296
• Weighted residual factors for all reflections included in the refinement: 0.354
• Goodness-of-fit parameter for all reflections included in the refinement: 1.2
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No