6-Chloro-3-{1-[(4-Chlorobenzyl)(Formyl)Amino]-2-[(2-Methyl-2-Propanyl)Amino]-2-Oxoethyl}-1H-Indole-2-Carboxylic Acid

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Properties Simple | Detailed

Formula C23H23Cl2N3O4
IUPAC Name 3-[(1s)-2-(tert-butylamino)-1-[(4-chlorophenyl)methyl-formyl-amino]-2-oxo-ethyl]-6-chloro-indol-1-ium-2-ylium-2-carboxylic acid
Molecular Mass 476.352 g·mol−1
Heat of Formation -618.9 ± 16.7 kJ·mol−1
Dipole Moment 4.15 ± 1.08 D
Volume 529.63 Å 3
Surface Area 393.93 Å 2
HOMO Energy -9.08 ± 0.55 eV
LUMO Energy 1.96 ± eV
Point Group Symmetry C1
InChIKey ZAOJHZGIRKVCBH-FQEVSTJZSA-N
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