Information card for entry 4068121

Structure parameters

• Formula: C57 H76 B2 Cl2 F8 N8 Rh2
• Calculated formula: C57 H76 B2 Cl2 F8 N8 Rh2
• Title of publication: Synthesis and Structure of Silver and Rhodium 1,2,3-Triazol-5-ylidene Mesoionic Carbene Complexes
• Authors of publication: Keske, Eric C.; Zenkina, Olena V.; Wang, Ruiyao; Crudden, Cathleen M.
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 1
• Pages of publication: 456
• a: 17.7866 ± 0.0009 Å
• b: 34.3081 ± 0.0017 Å
• c: 13.4527 ± 0.0007 Å
• α: 90°
• β: 128.05 ± 0.002°
• γ: 90°
• Cell volume: 6464.5 ± 0.6 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0524
• Residual factor for significantly intense reflections: 0.0436
• Weighted residual factors for significantly intense reflections: 0.1189
• Weighted residual factors for all reflections included in the refinement: 0.1276
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No