(2S,5S)-9-[(1S,2S)-2,3-Dihydroxy-1-(1H-Indol-3-Yl)Propyl]-5-(Hydroxymethyl)-2-Isopropyl-1-Methyl-1,2,4,5,6,8-Hexahydro-3H-[1,4]Diazonino[7,6,5-Cd]Indol-3-One

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Formula C25H23N4O4
IUPAC Name (2s,5s)-9-[(1s,2s)-2,3-dihydroxy-1-(1h-indol-3-yl)propyl]-5-(hydroxymethyl)-2-isopropyl-1-methyl-1,2,4,5,6,8-hexahydro-3h-[1,4]diazonino[7,6,5-cd]indol-3-one
Molecular Mass 443.475 g·mol−1
Heat of Formation -503.6 ± 16.7 kJ·mol−1
Dipole Moment 6.22 ± 1.08 D
Volume 587.49 Å 3
Surface Area 435.8 Å 2
HOMO Energy -7.96 ± 0.55 eV
LUMO Energy 2.36 ± eV
Point Group Symmetry C1
InChIKey NXVPLRFWXAISBZ-QLPZLAKISA-N
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