[(1S,9S,10S,11S,12S,17S)-12-Ethyl-14-Oxido-8,14-Diazapentacyclo[9.5.2.0~1,9~.0~2,7~.0~14,17~]Octadeca-2,4,6-Trien-10-Yl]Methanol

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Formula C19H27N2O2+
IUPAC Name [(1s,9s,10s,11s,12s,17s)-12-ethyl-14-oxido-8,14-diazapentacyclo[9.5.2.0 1,9 .0 2,7 .0 14,17 ]octadeca-2,4,6-trien-10-yl]methanol
Molecular Mass 315.430 g·mol−1
Heat of Formation -117.8 ± 16.7 kJ·mol−1
Dipole Moment 4.40 ± 1.08 D
Volume 383.52 Å 3
Surface Area 302.94 Å 2
HOMO Energy -8.45 ± 0.55 eV
LUMO Energy 3.12 ± eV
Point Group Symmetry C1
InChIKey TWXSNNUYFGAFNA-WLPRDMRESA-N
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