Information card for entry 7112650

Structure parameters

• Common name: Organic salt
• Chemical name: Organic salt
• Formula: C18 H24 B Cl N2 O0.41
• Calculated formula: C18 H24 B Cl N2 O0.408
• Title of publication: Oxidative C(sp3)-H bond cleavage, C-C and C[double bond, length as m-dash]C coupling at a boron center with O2 as the oxidant mediated by platinum(II)
• Authors of publication: S. Pal; P. Y. Zavalij; A. N. Vedernikov
• Journal of publication: Chem.Commun.
• Year of publication: 2014
• Journal volume: 50
• Pages of publication: 5376
• a: 8.4357 ± 0.0008 Å
• b: 13.7411 ± 0.0014 Å
• c: 15.5693 ± 0.0015 Å
• α: 79.68 ± 0.002°
• β: 80.34 ± 0.002°
• γ: 89.731 ± 0.002°
• Cell volume: 1749.8 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0531
• Residual factor for significantly intense reflections: 0.047
• Weighted residual factors for significantly intense reflections: 0.0915
• Weighted residual factors for all reflections included in the refinement: 0.0942
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No