[5-Methoxy-2-({[2-Nitro-4-(Trifluoromethyl)Phenyl]Sulfonyl}Carbamoyl)-1H-Indol-1-Yl]Acetic Acid

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Formula C19H14F3N3O8S
IUPAC Name 2-[5-methoxy-2-[[2-nitro-4-(trifluoromethyl)phenyl]sulfonylcarbamoyl]indol-1-ium-2-ylium-1-yl]acetic acid
Molecular Mass 501.390 g·mol−1
Heat of Formation -1386.1 ± 16.7 kJ·mol−1
Dipole Moment 3.89 ± 1.08 D
Volume 500.67 Å 3
Surface Area 412.64 Å 2
HOMO Energy -8.65 ± 0.55 eV
LUMO Energy -1.99 ± eV
Point Group Symmetry C1
InChIKey PCVZSEOYPYERFT-UHFFFAOYSA-N
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