Ethyl 21,21,21-Trifluoroeburnamenine-14-Carboxylate

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Properties Simple | Detailed

Formula C22H23F3N2O2
IUPAC Name ethyl 21,21,21-trifluoroeburnamenine-14-carboxylate
Molecular Mass 404.425 g·mol−1
Heat of Formation -785.5 ± 16.7 kJ·mol−1
Dipole Moment 2.23 ± 1.08 D
Volume 455.52 Å 3
Surface Area 365.0 Å 2
HOMO Energy -8.39 ± 0.55 eV
LUMO Energy 2.44 ± eV
Point Group Symmetry C1
InChIKey NALBTKVBJYORJH-TZIWHRDSSA-N
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