(1R,3As,8As)-5-{[(2-Ethylphenyl)Carbamoyl]Oxy}-1-Hydroxy-1,3A,8-Trimethyl-1,2,3,3A,8,8A-Hexahydropyrrolo[2,3-B]Indol-1-Ium

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Formula C22H28N3O3+
IUPAC Name [(3s,3as,4s,8br)-3,4,8b-trimethyl-3-oxido-2,3a-dihydro-1h-pyrrolo[2,3-b]indol-3-ium-7-yl] n-(2-ethylphenyl)carbamate
Molecular Mass 382.476 g·mol−1
Heat of Formation -53.7 ± 16.7 kJ·mol−1
Dipole Moment 3.80 ± 1.08 D
Volume 463.99 Å 3
Surface Area 398.74 Å 2
HOMO Energy -8.42 ± 0.55 eV
LUMO Energy 2.91 ± eV
Point Group Symmetry C1
InChIKey AJWNTIIQZLHZRZ-HOKHCIIBSA-O
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