Information card for entry 7126949

Structure parameters

• Formula: C93.64 H148.93 K2 N2 Ni3 O8 P2 Si4
• Calculated formula: C95.732 H156 K2 N2 Ni3 O8 P2 Si4
• Title of publication: Ligand architecture for triangular metal complexes: a high oxidation state Ni₃ cluster with proximal metal arrangement.
• Authors of publication: Shoshani, Manar M.; Agapie, Theodor
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2020
• Journal volume: 56
• Journal issue: 76
• Pages of publication: 11279 - 11282
• a: 28.067 ± 0.006 Å
• b: 20.574 ± 0.004 Å
• c: 18.052 ± 0.004 Å
• α: 90°
• β: 97.215 ± 0.007°
• γ: 90°
• Cell volume: 10342 ± 4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.085
• Residual factor for significantly intense reflections: 0.0562
• Weighted residual factors for significantly intense reflections: 0.1475
• Weighted residual factors for all reflections included in the refinement: 0.1755
• Goodness-of-fit parameter for all reflections included in the refinement: 1.101
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No