Information card for entry 4337296

Structure parameters

• Formula: C56 H66 N2 P2 Pt
• Calculated formula: C56 H66 N2 P2 Pt
• Title of publication: A combined computational and spectroelectrochemical study of platinum-bridged bis-triarylamine systems.
• Authors of publication: Parthey, Matthias; Vincent, Kevin B.; Renz, Manuel; Schauer, Phil A.; Yufit, Dmitry S.; Howard, Judith A. K.; Kaupp, Martin; Low, Paul J.
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 3
• Pages of publication: 1544 - 1554
• a: 9.9533 ± 0.0005 Å
• b: 11.0652 ± 0.0007 Å
• c: 11.5908 ± 0.0007 Å
• α: 76.561 ± 0.005°
• β: 88.071 ± 0.004°
• γ: 85.292 ± 0.005°
• Cell volume: 1237.27 ± 0.13 ų
• Cell temperature: 120 K
• Ambient diffraction temperature: 120 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0315
• Residual factor for significantly intense reflections: 0.0292
• Weighted residual factors for significantly intense reflections: 0.0623
• Weighted residual factors for all reflections included in the refinement: 0.0636
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Diffraction radiation X-ray symbol: Mo
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No