Information card for entry 7018166

Structure parameters

• Formula: C30 H27 P S
• Calculated formula: C30 H27 P S0.995
• Title of publication: Facile synthesis of luminescent benzo-1,2-dihydrophosphinines from a phosphaalkene.
• Authors of publication: Pavelka, Laura C.; Baines, Kim M.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 11
• Pages of publication: 3294 - 3301
• a: 11.307 ± 0.002 Å
• b: 11.822 ± 0.002 Å
• c: 20.33 ± 0.004 Å
• α: 87.82 ± 0.03°
• β: 76.16 ± 0.03°
• γ: 62.43 ± 0.03°
• Cell volume: 2330.7 ± 1.1 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0756
• Residual factor for significantly intense reflections: 0.0525
• Weighted residual factors for significantly intense reflections: 0.1286
• Weighted residual factors for all reflections included in the refinement: 0.1404
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No