Information card for entry 7003849

Structure parameters

• Formula: C47 H50 F15 N24 Ni4 O16 P S3
• Calculated formula: C47 H44 F11 N24 Ni4 O16 P0.333333 S3
• Title of publication: Complete and ‘incomplete’ [2 ×2] grids by self-assembly with a sterically hindered ditopic imidazole hydrazone ligand—structural and magnetic studies
• Authors of publication: Dawe, Louise N.; Thompson, Laurence K.
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 27
• Pages of publication: 3610 - 3618
• a: 42.677 ± 0.003 Å
• b: 42.677 ± 0.003 Å
• c: 22.0593 ± 0.0015 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 34794 ± 4 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 2 K
• Number of distinct elements: 8
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.0925
• Residual factor for significantly intense reflections: 0.0883
• Weighted residual factors for significantly intense reflections: 0.246
• Weighted residual factors for all reflections included in the refinement: 0.252
• Goodness-of-fit parameter for all reflections included in the refinement: 1.089
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No