Information card for entry 7001965

Structure parameters

• Formula: C58 H73 Fe N5 Si3
• Calculated formula: C58 H73 Fe N5 Si3
• Title of publication: Reactions of ‘pincer’ pyridine dicarbene complexes of Fe(0) with silanes
• Authors of publication: Pugh, David; Wells, Neil J.; Evans, David J.; Danopoulos, Andreas A.
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 35
• Pages of publication: 7189
• a: 14.6347 ± 0.0005 Å
• b: 17.4275 ± 0.0007 Å
• c: 20.498 ± 0.0007 Å
• α: 90°
• β: 90.266 ± 0.002°
• γ: 90°
• Cell volume: 5227.9 ± 0.3 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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: 0.1251
• Residual factor for significantly intense reflections: 0.0684
• Weighted residual factors for significantly intense reflections: 0.1279
• Weighted residual factors for all reflections included in the refinement: 0.1468
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No