Information card for entry 2009510

Structure parameters

• Chemical name: (2,2'-biquinoline)chloro(2,2':6',2"-terpyridine)ruthenium(II)
• Formula: C33 H23 Cl F6 N5 P Ru
• Calculated formula: C33 H23 Cl F6 N5 P Ru
• SMILES: [Ru]123(Cl)([n]4c(ccc5ccccc45)c4[n]1c1ccccc1cc4)[n]1c(cccc1)c1[n]2c(ccc1)c1[n]3cccc1.[P](F)(F)(F)(F)(F)[F-]
• Title of publication: (2,2'-Biquinoline-κ^2^<i>N</i>,<i>N</i>')chloro(2,2':6',2''-terpyridine-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'')ruthenium(II) hexafluorophosphate, [RuCl(C~18~H~12~N~2~)(C~15~H~11~N~3~)][PF~6~]
• Authors of publication: Spek, Anthony L.; Gerli, Alessandra; Reedijk, Jan
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1994
• Journal volume: 50
• Journal issue: 3
• Pages of publication: 394 - 397
• a: 11.6712 ± 0.001 Å
• b: 18.4964 ± 0.001 Å
• c: 15.406 ± 0.001 Å
• α: 90°
• β: 113.66 ± 0.01°
• γ: 90°
• Cell volume: 3046.2 ± 0.4 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.067
• Weighted residual factors for significantly intense reflections: 0.066
• Goodness-of-fit parameter for significantly intense reflections: 3.79
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No