(2S)-3-{2-[1-(4-Chlorobenzoyl)-5-Methoxy-2-Methyl-1H-Indol-3-Yl]Acetoxy}-2-Phenylpropanoic Acid

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Properties Simple | Detailed

Formula C28H24ClNO6
IUPAC Name (2s)-3-[2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-indol-1-ium-2-ylium-3-yl]acetyl]oxy-2-phenyl-propanoic acid
Molecular Mass 505.946 g·mol−1
Heat of Formation -809.2 ± 16.7 kJ·mol−1
Dipole Moment 2.05 ± 1.08 D
Volume 583.14 Å 3
Surface Area 425.52 Å 2
HOMO Energy -8.66 ± 0.55 eV
LUMO Energy -1.23 ± eV
Point Group Symmetry C1
InChIKey UCCJWNPWWPJKGL-XMMPIXPASA-N
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Elements H C N O Cl