Information card for entry 7053418

Structure parameters

• Formula: C43 H39.5 F12 N10.5 P2 Ru
• Calculated formula: C43 H39.5 F12 N10.5 P2 Ru
• Title of publication: Synthesis, structure and electrochemical behaviour of Ru(ii)- and Pt(ii)-carbene complexes of the NCN-pincer 1,3-bis(2-pyridylmethyl)-1H-benzimidazolium chloride
• Authors of publication: Das Adhikary, Sirsendu; Samanta, Tapastaru; Roymahapatra, Gourisankar; Loiseau, Frédérique; Jouvenot, Damien; Giri, Santanab; Chattaraj, Pratim K.; Dinda, Joydev
• Journal of publication: New Journal of Chemistry
• Year of publication: 2010
• Journal volume: 34
• Journal issue: 9
• Pages of publication: 1974
• a: 11.91 ± 0.001 Å
• b: 19.351 ± 0.002 Å
• c: 21.617 ± 0.003 Å
• α: 90°
• β: 90.2 ± 0.01°
• γ: 90°
• Cell volume: 4982 ± 1 ų
• Cell temperature: 200 K
• Ambient diffraction temperature: 200 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0632
• Residual factor for significantly intense reflections: 0.0632
• Weighted residual factors for all reflections: 0.0659
• Weighted residual factors for all reflections included in the refinement: 0.0659
• Goodness-of-fit parameter for all reflections: 1.948
• Goodness-of-fit parameter for all reflections included in the refinement: 1.948
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No