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A bis(BN-tolan) showed evidence of intermolecular NH⋅⋅⋅π hydrogen bonding in the solid state, which is consistent with the NH moiety possessing a hybrid character between an arene CH and an amine NH bond. See Ref. [6].
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A bis(BN-tolan) showed evidence of intermolecular NH⋅⋅⋅π hydrogen bonding in the solid state, which is consistent with the NH moiety possessing a hybrid character between an arene CH and an amine NH bond. See Ref. [6].
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According to TD-DFT calculations (B3LYP, 6-31G*) the lowest-energy vertical transition corresponds to HOMO–LUMO excitation, except for BN1. See Tables S7–S9.
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According to TD-DFT calculations (B3LYP, 6-31G*) the lowest-energy vertical transition corresponds to HOMO–LUMO excitation, except for BN1. See Tables S7–S9.
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