Information card for entry 7117880

Structure parameters

• Formula: C113.67 H108 Cl11 I12 N24 Pd6
• Calculated formula: C113.5 H108 Cl11.04 I12 N24 Pd6
• Title of publication: Triply cyclometalated trinuclear iridium(iii) and trinuclear palladium(ii) complexes with a tri-mesoionic carbene ligand.
• Authors of publication: Maity, Ramananda; Mekic, Amel; van der Meer, Margarethe; Verma, Amit; Sarkar, Biprajit
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2015
• Journal volume: 51
• Journal issue: 82
• Pages of publication: 15106 - 15109
• a: 35.2807 ± 0.0014 Å
• b: 35.2807 ± 0.0014 Å
• c: 10.4598 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 11275.3 ± 0.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.0572
• Residual factor for significantly intense reflections: 0.0418
• Weighted residual factors for significantly intense reflections: 0.0957
• Weighted residual factors for all reflections included in the refinement: 0.1034
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No