Information card for entry 7038258

Structure parameters

• Formula: C72 H56 B Br2 Cl F24 N4 Ru2
• Calculated formula: C72 H56 B Br2 Cl F24 N4 Ru2
• Title of publication: Unusual dimer formation of cyclometalated ruthenium NHC p-cymene complexes.
• Authors of publication: Schleicher, David; Tronnier, Alexander; Leopold, Hendrik; Borrmann, Horst; Strassner, Thomas
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 8
• Pages of publication: 3260 - 3263
• a: 13.8063 ± 0.0003 Å
• b: 13.2266 ± 0.0003 Å
• c: 41.551 ± 0.0011 Å
• α: 90°
• β: 97.253 ± 0.001°
• γ: 90°
• Cell volume: 7526.9 ± 0.3 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 8
• 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: 0.0574
• Residual factor for significantly intense reflections: 0.0515
• Weighted residual factors for significantly intense reflections: 0.1381
• Weighted residual factors for all reflections included in the refinement: 0.1428
• Goodness-of-fit parameter for all reflections included in the refinement: 1.106
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No