Information card for entry 7047731

Structure parameters

• Formula: C33 H57 Cl2 Ge Ir N2 O Si2
• Calculated formula: C33 H57 Cl2 Ge Ir N2 O Si2
• Title of publication: Cyclometallation of a germylene ligand by concerted metalation-deprotonation of a methyl group.
• Authors of publication: Bakthavachalam, K.; Dutta, Sayan; C, Arivazhagan; Raghavendra, Beesam; Haridas, Anagha; Sen, Sakya S.; Koley, Debasis; Ghosh, Sundargopal
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 44
• Pages of publication: 15835 - 15844
• a: 17.1906 ± 0.0013 Å
• b: 11.1401 ± 0.0007 Å
• c: 24.7705 ± 0.0017 Å
• α: 90°
• β: 107.867 ± 0.008°
• γ: 90°
• Cell volume: 4514.9 ± 0.6 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for all reflections: 0.0935
• Residual factor for significantly intense reflections: 0.0759
• Weighted residual factors for significantly intense reflections: 0.2126
• Weighted residual factors for all reflections included in the refinement: 0.233
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No