Information card for entry 4104095

Structure parameters

• Formula: C24 H32 Hf
• Calculated formula: C24 H32 Hf
• Title of publication: Combination of Spectroscopic Methods: In Situ NMR and UV/Vis Measurements To Understand the Formation of Group 4 Metallacyclopentanes from the Corresponding Metallacyclopropenes
• Authors of publication: Torsten Beweries; Christian Fischer; Stephan Peitz; Vladimir V. Burlakov; Perdita Arndt; Wolfgang Baumann; Anke Spannenberg; Detlef Heller; Uwe Rosenthal
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2009
• Journal volume: 131
• Pages of publication: 4463 - 4469
• a: 9.7076 ± 0.0004 Å
• b: 16.4786 ± 0.0007 Å
• c: 12.0871 ± 0.0006 Å
• α: 90°
• β: 101.802 ± 0.004°
• γ: 90°
• Cell volume: 1892.67 ± 0.15 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 3
• 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: 0.0227
• Residual factor for significantly intense reflections: 0.017
• Weighted residual factors for significantly intense reflections: 0.0384
• Weighted residual factors for all reflections included in the refinement: 0.0393
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No