Information card for entry 7233723

Structure parameters

• Formula: C36 H66 B Cl F4 N2 O2 P2 Ru
• Calculated formula: C36 H66 B Cl F4 N2 O2 P2 Ru
• Title of publication: Evidence for a photoinduced isonitrosyl isomer in ruthenium dinitrosyl compounds
• Authors of publication: Schaniel, Dominik; Casaretto, Nicolas; Bendeif, El-Eulmi; Woike, Theo; Gallien, Anna K. E.; Klüfers, Peter; Kutniewska, Sylwia E.; Kamiński, Radosław; Bouchez, Guillaume; Boukheddaden, Kamel; Pillet, Sébastien
• Journal of publication: CrystEngComm
• Year of publication: 2019
• Journal volume: 21
• Journal issue: 38
• Pages of publication: 5804
• a: 10.1159 ± 0.0005 Å
• b: 13.148 ± 0.0005 Å
• c: 16.2911 ± 0.0006 Å
• α: 80.81 ± 0.003°
• β: 84.854 ± 0.004°
• γ: 68.526 ± 0.004°
• Cell volume: 1989.34 ± 0.15 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 9
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0425
• Residual factor for significantly intense reflections: 0.0337
• Weighted residual factors for significantly intense reflections: 0.0719
• Weighted residual factors for all reflections included in the refinement: 0.077
• Goodness-of-fit parameter for all reflections included in the refinement: 1.083
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No