Information card for entry 7718455

Structure parameters

• Formula: C50.5 H88 Al4 Cr4
• Calculated formula: C40 H76 Al4 Cr4
• Title of publication: Revisiting the structure and properties of mid-valent monopentamethylcyclopentadienylchromium complexes.
• Authors of publication: Calvo-Molina, Adrián; Jover, Jesús; Pérez-Redondo, Adrián; Yélamos, Carlos
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 20
• Pages of publication: 8190 - 8203
• a: 14.1459 ± 0.0005 Å
• b: 21.5739 ± 0.0008 Å
• c: 18.3597 ± 0.0006 Å
• α: 90°
• β: 103.097 ± 0.001°
• γ: 90°
• Cell volume: 5457.3 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 4
• 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: 0.0476
• Residual factor for significantly intense reflections: 0.0372
• Weighted residual factors for significantly intense reflections: 0.1232
• Weighted residual factors for all reflections included in the refinement: 0.1383
• Goodness-of-fit parameter for all reflections included in the refinement: 1.14
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No