Information card for entry 7231190

Structure parameters

• Formula: C43 H30 Cl3 N3 O4 P2 W
• Calculated formula: C43 H30 Cl3 N3 O4 P2 W
• 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: 14.1865 ± 0.0003 Å
• b: 11.2881 ± 0.0003 Å
• c: 25.1974 ± 0.0009 Å
• α: 90°
• β: 97.169 ± 0.002°
• γ: 90°
• Cell volume: 4003.5 ± 0.2 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 7
• 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: 0.0453
• Residual factor for significantly intense reflections: 0.0379
• Weighted residual factors for significantly intense reflections: 0.0889
• Weighted residual factors for all reflections included in the refinement: 0.095
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No