(2R)-2-[(2,2-Dichloroacetyl)Amino]-3-(5-Nitro-2H-Indol-1-Ium-2-Ylium-3-Yl)Propanoic Acid

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Formula C13H11Cl2N3O5
IUPAC Name (2r)-2-[(2,2-dichloroacetyl)amino]-3-(5-nitro-2h-indol-1-ium-2-ylium-3-yl)propanoic acid
Molecular Mass 360.149 g·mol−1
Heat of Formation -518.0 ± 16.7 kJ·mol−1
Dipole Moment 4.49 ± 1.08 D
Volume 363.2 Å 3
Surface Area 296.52 Å 2
HOMO Energy -9.40 ± 0.55 eV
LUMO Energy 1.73 ± eV
Point Group Symmetry C1
InChIKey KHPVUOWJRQILID-SNVBAGLBSA-N
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Elements H C N O Cl