Information card for entry 7045288

Structure parameters

• Formula: C66 H120 Cl Co2 Li3 N12 O4 Si4
• Calculated formula: C66 H120 Cl Co2 Li3 N12 O4 Si4
• Title of publication: Dehydrohalogenation of proton responsive complexes: versatile aggregation via pyrazolate pincer ligand arms.
• Authors of publication: Cook, Brian J.; Chen, Chun-Hsing; Pink, Maren; Caulton, Kenneth G.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 6
• Pages of publication: 2052 - 2060
• a: 16.9176 ± 0.0004 Å
• b: 16.9481 ± 0.0004 Å
• c: 17.4847 ± 0.0004 Å
• α: 63.744 ± 0.001°
• β: 67.357 ± 0.001°
• γ: 88.247 ± 0.001°
• Cell volume: 4089.91 ± 0.18 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0725
• Residual factor for significantly intense reflections: 0.057
• Weighted residual factors for all reflections: 0.1674
• Weighted residual factors for significantly intense reflections: 0.1522
• Weighted residual factors for all reflections included in the refinement: 0.1673
• Goodness-of-fit parameter for all reflections included in the refinement: 0.9919
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No