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0345492633
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note
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AM1 - Δγ|. This procedure gave Δγ = 0.115 ± 0.003 eV for diradicals 1 and 0.114 ± 0.003 eV for diradicals 2.
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85
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0000328867
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0345061062
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note
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AB are expected to increase the ionic contributions to the ground-state singlet wave function of nonplanar phenylnitrenes by second-order interactions.
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88
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0345061061
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note
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a and ln A, eq 7), then EEC and IKR are synonymous.
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92
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0344630459
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note
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AM1 given in Table 1.
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95
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33847798713
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Krug, R. R.; Hunter, W. G.; Grieger, R. A. J. Phys. Chem. 1976, 80, 2335 and 2341.
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0345061059
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note
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a.
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100
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85050694062
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