Information card for entry 7720305

Structure parameters

• Formula: C38 H51 Cl4 Co N O1.5 Re
• Calculated formula: C38 H51 Cl4 Co N O1.5 Re
• Title of publication: Electronic structure and magnetic properties of rhenium complexes with an iminoxolene ligand: experimental and computational studies.
• Authors of publication: Petrov, Pavel A.; Dmitriev, Alexey A.; Semikina, Anastasiia D.; Eltsov, Ilia V.; Sukhikh, Taisiya S.; Lavrov, Alexander N.; Gushchin, Artem L.; Sokolov, Maxim N.; Gritsan, Nina P.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2026
• Journal volume: 55
• Journal issue: 8
• Pages of publication: 3428 - 3441
• a: 40.471 ± 0.003 Å
• b: 10.0512 ± 0.0006 Å
• c: 19.8546 ± 0.0014 Å
• α: 90°
• β: 101.752 ± 0.004°
• γ: 90°
• Cell volume: 7907.2 ± 0.9 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0614
• Residual factor for significantly intense reflections: 0.0565
• Weighted residual factors for significantly intense reflections: 0.1391
• Weighted residual factors for all reflections included in the refinement: 0.1426
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No