Information card for entry 7700774

Structure parameters

• Common name: trans-[Re(PEt3)2(sal2ibn)][PF6]
• Formula: C30 H48 F6 N2 O2 P3 Re
• Calculated formula: C30 H48 F6 N2 O2 P3 Re
• Title of publication: Steric influence of salicylaldehyde-based Schiff base ligands on the formation of trans-[Re(PR₃)₂(Schiff base)]⁺ complexes.
• Authors of publication: Baumeister, Jakob E.; Mitchell, Andrew W.; Kelley, Steven P.; Barnes, Charles L.; Jurisson, Silvia S.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 34
• Pages of publication: 12943 - 12955
• a: 23.1732 ± 0.0018 Å
• b: 15.547 ± 0.0012 Å
• c: 21.3236 ± 0.0017 Å
• α: 90°
• β: 117.133 ± 0.001°
• γ: 90°
• Cell volume: 6836.9 ± 0.9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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: 0.0423
• Residual factor for significantly intense reflections: 0.0263
• Weighted residual factors for significantly intense reflections: 0.0473
• Weighted residual factors for all reflections included in the refinement: 0.0501
• Goodness-of-fit parameter for all reflections included in the refinement: 0.944
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No