Information card for entry 4324861

Structure parameters

• Formula: C93 H94 B2 P2 Pt
• Calculated formula: C93 H93 B2 P2 Pt
• Title of publication: Probing the Structural Origins of Vapochromism of a Triarylboron-Functionalized Platinum(II) Acetylide by Optical and Multinuclear Solid-State NMR Spectroscopy
• Authors of publication: Zachary M. Hudson; Christina Sun; Kristopher J. Harris; Bryan E. G. Lucier; Robert W. Schurko; Suning Wang
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 3447 - 3457
• a: 24.4132 ± 0.0003 Å
• b: 14.6769 ± 0.0002 Å
• c: 25.1137 ± 0.0004 Å
• α: 90°
• β: 109.719 ± 0.001°
• γ: 90°
• Cell volume: 8470.8 ± 0.2 ų
• Cell temperature: 179 ± 2 K
• Ambient diffraction temperature: 179 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0998
• Residual factor for significantly intense reflections: 0.0534
• Weighted residual factors for significantly intense reflections: 0.1268
• Weighted residual factors for all reflections included in the refinement: 0.1495
• Goodness-of-fit parameter for all reflections included in the refinement: 0.996
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No