Information card for entry 7719374

Structure parameters

• Formula: C22 H45 B2 Br O2 P2
• Calculated formula: C22 H45 B2 Br O2 P2
• Title of publication: Remarkable coordination variability of the P,C,P-pincer ligand in organotin(IV) compounds - a promising outlook for other p-block elements.
• Authors of publication: Chlebík, Richard; Kertész, Erik; Erben, Milan; Růžička, Aleš; Jambor, Roman; Benkő, Zoltán; Dostál, Libor
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 40
• Pages of publication: 15093 - 15106
• a: 7.7135 ± 0.0002 Å
• b: 13.7681 ± 0.0004 Å
• c: 25.706 ± 0.0007 Å
• α: 90°
• β: 90.088 ± 0.001°
• γ: 90°
• Cell volume: 2729.98 ± 0.13 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0328
• Residual factor for significantly intense reflections: 0.0247
• Weighted residual factors for significantly intense reflections: 0.0595
• Weighted residual factors for all reflections included in the refinement: 0.0633
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No