Isoaaptamine

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Formula C13H12N2O2
IUPAC Name 11-methoxy-2-methyl-2,6-diazatricyclo[7.3.1.05,13]trideca-1(13),3,5,7,9,11-hexaen-12-ol
Molecular Mass 228.247 g·mol−1
Heat of Formation -79.0 ± 16.7 kJ·mol−1
Dipole Moment 4.80 ± 1.08 D
Volume 258.37 Å 3
Surface Area 240.07 Å 2
HOMO Energy -7.57 ± 0.55 eV
LUMO Energy -0.39 ± eV
Point Group Symmetry C1
InChIKey MPBUGSHDXOJPKR-UHFFFAOYSA-N
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