Information card for entry 4067785

Structure parameters

• Formula: C23.5 H24 Cl3 N O3 Pt S
• Calculated formula: C23.5 H24 Cl3 N O3 Pt S
• Title of publication: New C∧N∧C Bis-Cyclometalated Platinum(II) Complexes: Synthesis, Structures, and Photophysical Properties
• Authors of publication: Fuertes, Sara; Brayshaw, Simon K.; Raithby, Paul R.; Schiffers, Stephanie; Warren, Mark R.
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 1
• Pages of publication: 105
• a: 6.8179 ± 0.0001 Å
• b: 12.9134 ± 0.0002 Å
• c: 14.4381 ± 0.0002 Å
• α: 88.678 ± 0.001°
• β: 77.306 ± 0.001°
• γ: 85.367 ± 0.001°
• Cell volume: 1236.02 ± 0.03 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0398
• Residual factor for significantly intense reflections: 0.0297
• Weighted residual factors for significantly intense reflections: 0.0736
• Weighted residual factors for all reflections included in the refinement: 0.0787
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No