Information card for entry 7023796

Structure parameters

• Common name: [HB(3,5-(CF3)2Pz)3]Ag(cyclooctene)
• Formula: C23 H18 Ag B F18 N6
• Calculated formula: C23 H18 Ag B F18 N6
• SMILES: [Ag]123([n]4n(c(cc4C(F)(F)F)C(F)(F)F)[BH](n4[n]1c(cc4C(F)(F)F)C(F)(F)F)n1[n]2c(cc1C(F)(F)F)C(F)(F)F)[CH]1=[CH]3CCCCCC1
• Title of publication: Silver(i) complexes of tris(pyrazolyl)borate ligands bearing six trifluoromethyl and three additional electron-withdrawing substituents.
• Authors of publication: Jayaratna, Naleen B.; Pardue, Daniel B.; Ray, Sriparna; Yousufuddin, Muhammed; Thakur, Krishna G.; Cundari, Thomas R.; Dias, H. V. Rasika
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 43
• Pages of publication: 15399 - 15410
• a: 10.5488 ± 0.0004 Å
• b: 16.9402 ± 0.0007 Å
• c: 17.4895 ± 0.0007 Å
• α: 83.886 ± 0.001°
• β: 74.977 ± 0.001°
• γ: 81.857 ± 0.001°
• Cell volume: 2980.1 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0444
• Residual factor for significantly intense reflections: 0.0314
• Weighted residual factors for significantly intense reflections: 0.0712
• Weighted residual factors for all reflections included in the refinement: 0.0757
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No