(2S,5S)-5-Amino-4-Oxo-1,2,4,5,6,7-Hexahydroazepino[3,2,1-Hi]Indole-2-Carboxylic Acid

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Formula C13H14N2O3
IUPAC Name (2s,11s)-11-amino-12-oxo-1-azatricyclo[6.4.1.04,13]trideca-4,6,8(13)-triene-2-carboxylic acid
Molecular Mass 246.262 g·mol−1
Heat of Formation -439.6 ± 16.7 kJ·mol−1
Dipole Moment 3.37 ± 1.08 D
Volume 280.53 Å 3
Surface Area 246.67 Å 2
HOMO Energy -8.84 ± 0.55 eV
LUMO Energy -0.52 ± eV
Point Group Symmetry C1
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InChIKey KCYCGNHQFGTGSS-UWVGGRQHSA-N
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