Information card for entry 7032889

Structure parameters

• Formula: C28 H22 Cl6 I5 N8 Pd2
• Calculated formula: C28 H22 Cl6 I4 N8 Pd2
• SMILES: c1(c(c2ccc(c3c(n(CC)n[n+]3C)[Pd](I)(I)[n]3ccccc3)cc2)[n+](C)nn1CC)[Pd](I)(I)[n]1ccccc1.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl
• Title of publication: Redox-active multinuclear Pd(II) complexes with bis- and tris-mesoionic carbenes.
• Authors of publication: Maity, Ramananda; van der Meer, Margarethe; Sarkar, Biprajit
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 1
• Pages of publication: 46 - 49
• a: 15.427 ± 0.005 Å
• b: 11.379 ± 0.004 Å
• c: 24.293 ± 0.008 Å
• α: 90°
• β: 91.044 ± 0.007°
• γ: 90°
• Cell volume: 4264 ± 2 ų
• Cell temperature: 140 ± 2 K
• Ambient diffraction temperature: 140 ± 2 K
• Number of distinct elements: 6
• 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: 0.0627
• Residual factor for significantly intense reflections: 0.0521
• Weighted residual factors for significantly intense reflections: 0.1266
• Weighted residual factors for all reflections included in the refinement: 0.1309
• Goodness-of-fit parameter for all reflections included in the refinement: 1.203
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No