Information card for entry 7720819

Structure parameters

• Formula: C28 H40.5 F18 N6.5 O3.5 P3 Re
• Calculated formula: C28 H40.5 F18 N6.5 O3.5 P3 Re
• Title of publication: Pendant-cation assisted spontaneous axial halide substitution in group 7 M(L)(CO)₃X complexes.
• Authors of publication: Kramer, Wesley W.; Sheridan, Thomas R.; Pérez-Vázquez, Jorge; Boivin, Christophe A.; Browne, Amanda M.; Logan, Catherine G.; Sanders, Brian C.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2026
• Journal volume: 55
• Journal issue: 13
• Pages of publication: 5197 - 5209
• a: 13.0356 ± 0.0006 Å
• b: 13.2377 ± 0.0006 Å
• c: 14.7412 ± 0.0007 Å
• α: 113.893 ± 0.0017°
• β: 96.814 ± 0.002°
• γ: 111.367 ± 0.0018°
• Cell volume: 2057.32 ± 0.18 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0644
• Residual factor for significantly intense reflections: 0.0415
• Weighted residual factors for significantly intense reflections: 0.0665
• Weighted residual factors for all reflections included in the refinement: 0.0717
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No