Information card for entry 7123368

Structure parameters

• Formula: C65 H86 N4 O5 Re Sm
• Calculated formula: C65 H86 N4 O5 Re Sm
• Title of publication: Rhenium is different: CO tetramerization induced by a divalent lanthanide complex in rhenium carbonyls
• Authors of publication: Yadav, Ravi; Simler, Thomas; Gamer, Michael T.; Köppe, Ralf; Roesky, Peter W.
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 16.7981 ± 0.0004 Å
• b: 19.3819 ± 0.0005 Å
• c: 19.0314 ± 0.0006 Å
• α: 90°
• β: 96.237 ± 0.002°
• γ: 90°
• Cell volume: 6159.6 ± 0.3 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 6
• 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: 0.0512
• Residual factor for significantly intense reflections: 0.0333
• Weighted residual factors for significantly intense reflections: 0.0786
• Weighted residual factors for all reflections included in the refinement: 0.0836
• Goodness-of-fit parameter for all reflections included in the refinement: 0.965
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No