5-[(2S)-2-{[(1H-Indol-3-Ylacetyl)Amino]Methyl}-4-Methylpentyl]-1,3-Benzodioxole-4-Carboxylic Acid

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Formula C25H28N2O5
IUPAC Name 5-[(2s)-2-[[(2-indol-1-ium-3-id-3-ylacetyl)amino]methyl]-4-methyl-pentyl]-1,3-benzodioxole-4-carboxylic acid
Molecular Mass 436.500 g·mol−1
Heat of Formation -745.1 ± 16.7 kJ·mol−1
Dipole Moment 5.13 ± 1.08 D
Volume 527.44 Å 3
Surface Area 374.87 Å 2
HOMO Energy -8.58 ± 0.55 eV
LUMO Energy 2.10 ± eV
Point Group Symmetry C1
InChIKey MHGZHTDTSPSYHZ-INIZCTEOSA-N
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