Information card for entry 7231187

Structure parameters

• Formula: C38 H29 N3 P2
• Calculated formula: C38 H29 N3 P2
• Title of publication: 1,2,3-Triazole based bisphosphine, 5-(diphenylphosphanyl)-1-(2-(diphenylphosphanyl)-phenyl)-4-phenyl-1H-1,2,3-triazole: an ambidentate ligand with switchable coordination modes
• Authors of publication: Radhakrishna, Latchupatula; Pandey, Madhusudan K.; Balakrishna, Maravanji S.
• Journal of publication: RSC Advances
• Year of publication: 2018
• Journal volume: 8
• Journal issue: 45
• Pages of publication: 25704
• a: 15.517 ± 0.0011 Å
• b: 11.9307 ± 0.0007 Å
• c: 18.3226 ± 0.0015 Å
• α: 90°
• β: 111.801 ± 0.009°
• γ: 90°
• Cell volume: 3149.4 ± 0.4 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 4
• 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: 0.0785
• Residual factor for significantly intense reflections: 0.0555
• Weighted residual factors for significantly intense reflections: 0.1341
• Weighted residual factors for all reflections included in the refinement: 0.1586
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No