Information card for entry 7709568

Structure parameters

• Formula: C80 H164 Cl2 Mn4 N8 Si12
• Calculated formula: C80 H164 Cl2 Mn4 N8 Si12
• Title of publication: Trisyl-based multidentate ligands: synthesis and their transition-metal complexes
• Authors of publication: Yin, Zhu-Bao; Wei, Junnian; Xi, Zhenfeng
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 10.4374 ± 0.0006 Å
• b: 15.6526 ± 0.0008 Å
• c: 18.7151 ± 0.001 Å
• α: 107.997 ± 0.005°
• β: 105.323 ± 0.005°
• γ: 101.251 ± 0.005°
• Cell volume: 2673.9 ± 0.3 ų
• Cell temperature: 180 ± 0.1 K
• Ambient diffraction temperature: 180 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0957
• Residual factor for significantly intense reflections: 0.0719
• Weighted residual factors for significantly intense reflections: 0.1917
• Weighted residual factors for all reflections included in the refinement: 0.21
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No