Information card for entry 4337102

Structure parameters

• Chemical name: Diiodo-(1,1'-dipentyl-3,3'-methylene-bis(benzimidazoline)-2,2'-diylidene) -platinum(II) dichloromethane and methanol solvate 3/1/1
• Formula: C25.67 H34 Cl0.67 I2 N4 O0.33 Pt
• Calculated formula: C24.6666 H31.0002 Cl0.6666 I2 N4 O0.3333 Pt
• Title of publication: Tuning the Luminescent Properties of Pt(II) Acetylide Complexes through Varying the Electronic Properties of N-Heterocyclic Carbene Ligands.
• Authors of publication: Zhang, Yuzhen; Clavadetscher, Jessica; Bachmann, Michael; Blacque, Olivier; Venkatesan, Koushik
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 2
• Pages of publication: 756 - 771
• a: 17.5075 ± 0.0002 Å
• b: 17.5075 ± 0.0002 Å
• c: 16.9453 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 4498.09 ± 0.09 ų
• Cell temperature: 183.1 K
• Ambient diffraction temperature: 183 ± 2 K
• Number of distinct elements: 7
• Space group number: 176
• Hermann-Mauguin space group symbol: P 63/m
• Hall space group symbol: -P 6c
• Residual factor for all reflections: 0.0467
• Residual factor for significantly intense reflections: 0.0391
• Weighted residual factors for significantly intense reflections: 0.1024
• Weighted residual factors for all reflections included in the refinement: 0.1063
• Goodness-of-fit parameter for all reflections included in the refinement: 1.12
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No