Information card for entry 7001198

Structure parameters

• Formula: C67 H54 B2 Cl5 Hg Ir N12 O5 P2 W2
• Calculated formula: C67 H54 B2 Cl5 Hg Ir N12 O5 P2 W2
• Title of publication: Iridium tricarbido complexes via transmetallation with tricarbidomercurials
• Authors of publication: Dewhurst, Rian D.; Hill, Anthony F.; Willis, Anthony C.
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 18
• Pages of publication: 3384 - 3387
• a: 12.042 ± 0.0004 Å
• b: 12.69 ± 0.0004 Å
• c: 14.335 ± 0.0003 Å
• α: 65.907 ± 0.0017°
• β: 86.926 ± 0.0019°
• γ: 66.335 ± 0.0016°
• Cell volume: 1815.59 ± 0.1 ų
• Cell temperature: 200 K
• Ambient diffraction temperature: 200 K
• Number of distinct elements: 10
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0738
• Residual factor for significantly intense reflections: 0.0454
• Weighted residual factors for all reflections: 0.041
• Weighted residual factors for significantly intense reflections: 0.0377
• Weighted residual factors for all reflections included in the refinement: 0.0377
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0179
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No