Information card for entry 7720882

Structure parameters

• Formula: C30 H40 N3 O4 Re
• Calculated formula: C30 H40 N3 O4 Re
• Title of publication: Synthesis of a rhenium(VII) trioxo complex supported by a triphyrin ligand: oxygenation chemistry and deposition on Au(111).
• Authors of publication: Nguyen, Manh Linh; Strunskus, Thomas; Näther, Christian; Krahmer, Jan; Tuczek, Felix
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2026
• Journal volume: 55
• Journal issue: 17
• Pages of publication: 6944 - 6953
• a: 14.67065 ± 0.00007 Å
• b: 11.75682 ± 0.00006 Å
• c: 17.06503 ± 0.0001 Å
• α: 90°
• β: 101.076 ± 0.0005°
• γ: 90°
• Cell volume: 2888.56 ± 0.03 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 5
• 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: 0.029
• Residual factor for significantly intense reflections: 0.0283
• Weighted residual factors for significantly intense reflections: 0.0754
• Weighted residual factors for all reflections included in the refinement: 0.0759
• Goodness-of-fit parameter for all reflections included in the refinement: 1.094
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No