Skip to main content
. 2016 Jul 5;113(29):8115–8120. doi: 10.1073/pnas.1517189113

Table S2.

Total Dexter coupling and BE and DAE contributions of seven-bond folded alkanes (Fig. 2B) with lowered average energy gaps compared with the values for Table S1 (main text)

Conformation Vtr, eV Vtr(be), eV Vtr(dae), eV
Conf1 2.14×104 2.17×104 1.33×106
Conf2 4.67×105 4.68×105 1.58×107
Conf3 2.34×105 4.26×105 1.58×105
Conf4 2.68×104 2.43×104 2.46×105
Conf5 1.60×104 1.12×104 3.41×105