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. Author manuscript; available in PMC: 2016 May 7.
Published in final edited form as: J Phys Chem B. 2016 Mar 24;120(13):3311–3317. doi: 10.1021/acs.jpcb.6b00515

Scheme 2.

Scheme 2

Schematic Illustration of the Possible LE State and TICT by Rotating the Amine Group in 1a–ZnX2 (shown in 1a–ZnX2 → 3) a

aThe charge transfer state could also be achieved by rotating σ-bond #2 between the phenyl and pyridyl groups (5 → 4).