Information card for entry 7128217

Structure parameters

• Formula: C25 H48 Cl7 Cr3 O6
• Calculated formula: C25 H48 Cl7 Cr3 O6
• Title of publication: A trinuclear chromium(iii) chlorocarbyne.
• Authors of publication: Kurogi, Takashi; Irifune, Keiichi; Enoki, Takahiro; Takai, Kazuhiko
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2021
• Journal volume: 57
• Journal issue: 42
• Pages of publication: 5199 - 5202
• a: 10.107 ± 0.003 Å
• b: 18.184 ± 0.005 Å
• c: 19.257 ± 0.005 Å
• α: 90°
• β: 93.951 ± 0.004°
• γ: 90°
• Cell volume: 3530.7 ± 1.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.0916
• Residual factor for significantly intense reflections: 0.0777
• Weighted residual factors for significantly intense reflections: 0.1753
• Weighted residual factors for all reflections included in the refinement: 0.1845
• Goodness-of-fit parameter for all reflections included in the refinement: 1.203
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No