Information card for entry 7036655

Structure parameters

• Formula: C28 H34 Cl4 I4 N8 Pt2
• Calculated formula: C28 H34 Cl4 I4 N8 Pt2
• SMILES: c1(c(c2ccc(c3c(n(CC)n[n+]3C)[Pt](I)(I)[n]3ccccc3)cc2)n(C)n[n+]1CC)[Pt](I)(I)[n]1ccccc1.ClCCl.ClCCl
• Title of publication: C-H activation in Ir(III) and N-demethylation in Pt(II) complexes with mesoionic carbene ligands: examples of monometallic, homobimetallic and heterobimetallic complexes.
• Authors of publication: Maity, Ramananda; Tichter, Tim; van der Meer, Margarethe; Sarkar, Biprajit
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 42
• Pages of publication: 18311 - 18315
• a: 9.5699 ± 0.0019 Å
• b: 10.094 ± 0.002 Å
• c: 12.494 ± 0.003 Å
• α: 101.63 ± 0.03°
• β: 104.74 ± 0.03°
• γ: 110.9 ± 0.03°
• Cell volume: 1031.7 ± 0.6 ų
• Cell temperature: 140 ± 2 K
• Ambient diffraction temperature: 140 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0294
• Residual factor for significantly intense reflections: 0.0251
• Weighted residual factors for significantly intense reflections: 0.0643
• Weighted residual factors for all reflections included in the refinement: 0.0664
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No