Information card for entry 4338668

Structure parameters

• Formula: C94.5 H107 Al1.5 Cl5.5 Cr6 N8 O0 P4
• Calculated formula: C94.5 H107 Al1.5 Cl5.5 Cr6 N8 P4
• Title of publication: Isolation of a hexanuclear chromium cluster with a tetrahedral hydridic core and its catalytic behavior for ethylene oligomerization.
• Authors of publication: Alzamly, Ahmed; Gambarotta, Sandro; Korobkov, Ilia; Murugesu, Muralee; Le Roy, Jennifer J. H.; Budzelaar, Peter H. M.
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 12
• Pages of publication: 6073 - 6081
• a: 38.3455 ± 0.0011 Å
• b: 11.3143 ± 0.0003 Å
• c: 30.4666 ± 0.0014 Å
• α: 90°
• β: 127.662 ± 0.0009°
• γ: 90°
• Cell volume: 10463.8 ± 0.6 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 8
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1006
• Residual factor for significantly intense reflections: 0.059
• Weighted residual factors for significantly intense reflections: 0.1404
• Weighted residual factors for all reflections included in the refinement: 0.1624
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No