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- W2010996811 abstract "Cobalt-59 NMR spectra of a single crystal of tris(2,4-pentanedionato-O,O‘) cobalt(III) were obtained as a function of crystal orientation in an applied magnetic field of 9.40 T. The analysis provides the magnitudes and orientations of the 59Co nuclear quadrupole coupling and chemical shift tensors for each of the two magnetically distinct but crystallographically equivalent cobalt sites. The cobalt electric field gradient and chemical shift tensors are not coincident, but their unique components are close to the approximate C3 axis of the complex. Small deviations from perfect octahedral symmetry at the cobalt nucleus result in a significant nuclear electric field gradient and highly anisotropic chemical shift. The cobalt nuclear quadrupolar coupling constant is 5.53 ± 0.10 MHz with an asymmetry of 0.219 ± 0.005, while the chemical shift tensor has a span of 1174 ± 25 ppm. The principal components relative to the isotropic chemical shift, δiso = 12498 ± 5 ppm, are δ11 = 698 ± 22 ppm, δ22 = −222 ± 12 ppm, ..." @default.
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- W2010996811 date "1997-07-01" @default.
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- W2010996811 title "Single-Crystal Cobalt-59 NMR Study of Tris(2,4-pentanedionato-<i>O</i>,<i>O</i>‘)cobalt(III)" @default.
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- W2010996811 doi "https://doi.org/10.1021/jp970370i" @default.
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