Information card for entry 7129132

Structure parameters

• Formula: C32.5 H39.5 Cl3 Ga N2 O
• Calculated formula: C32.5 H39.5 Cl3 Ga N2 O
• Title of publication: Synthesis, structural characterization, and coordination chemistry of imidazole-based alkylidene ketenes.
• Authors of publication: Feuerstein, Wolfram; Varava, Paul; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Severin, Kay
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2021
• Journal volume: 57
• Journal issue: 87
• Pages of publication: 11509 - 11512
• a: 10.39335 ± 0.00014 Å
• b: 19.4815 ± 0.0002 Å
• c: 16.5164 ± 0.0002 Å
• α: 90°
• β: 100.79 ± 0.0013°
• γ: 90°
• Cell volume: 3285.08 ± 0.07 ų
• Cell temperature: 140 ± 0.1 K
• Ambient diffraction temperature: 140 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0397
• Residual factor for significantly intense reflections: 0.032
• Weighted residual factors for significantly intense reflections: 0.0826
• Weighted residual factors for all reflections included in the refinement: 0.0877
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No