Information card for entry 7037600

Structure parameters

• Formula: C30 H33 F12 N6 Sm
• Calculated formula: C30 H33 F12 N6 Sm
• SMILES: [Sm]12345([F]c6c(N1CC[N]2(C)C)c(F)c(F)cc6F)(N(c1c([F]4)c(F)cc(F)c1F)CC[N]3(C)C)N(c1c(F)c(F)cc(F)c1F)CC[N]5(C)C
• Title of publication: Exploring the effect of the Ln(III)/Ln(II) redox potential on C-F activation and on oxidation of some lanthanoid organoamides.
• Authors of publication: Deacon, Glen B.; Junk, Peter C.; Kelly, Rory P.; Wang, Jun
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 4
• Pages of publication: 1422 - 1435
• a: 9.743 ± 0.0019 Å
• b: 9.781 ± 0.002 Å
• c: 17.828 ± 0.004 Å
• α: 89.78 ± 0.03°
• β: 75.07 ± 0.03°
• γ: 81.69 ± 0.03°
• Cell volume: 1623.4 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.031
• Residual factor for significantly intense reflections: 0.0306
• Weighted residual factors for significantly intense reflections: 0.0795
• Weighted residual factors for all reflections included in the refinement: 0.0798
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 0.7109 Å
• Diffraction radiation type: Synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No