Information card for entry 7024824

Structure parameters

• Formula: C79.5 H73 Cl4 N2 O3 Rh
• Calculated formula: C79.4995 H72.999 Cl3.999 N2 O3 Rh
• Title of publication: IPr* an easily accessible highly hindered N-heterocyclic carbene.
• Authors of publication: Berthon-Gelloz, Guillaume; Siegler, Maxime A.; Spek, Anthony L.; Tinant, Bernard; Reek, Joost N. H.; Markó, István E
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 6
• Pages of publication: 1444 - 1446
• a: 14.1205 ± 0.0002 Å
• b: 15.1256 ± 0.0003 Å
• c: 19.1389 ± 0.0005 Å
• α: 86.866 ± 0.001°
• β: 87.613 ± 0.001°
• γ: 62.432 ± 0.001°
• Cell volume: 3617.56 ± 0.13 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.055
• Residual factor for significantly intense reflections: 0.0416
• Weighted residual factors for significantly intense reflections: 0.1005
• Weighted residual factors for all reflections included in the refinement: 0.1062
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No