2-[5-Chloro-2-[(4-Cyano-3-Nitro-Phenyl)Methylcarbamoyl]Phenoxy]Acetic Acid

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Formula C17H12ClN3O6
IUPAC Name 2-[5-chloro-2-[(4-cyano-3-nitro-phenyl)methylcarbamoyl]phenoxy]acetic acid
Molecular Mass 389.747 g·mol−1
Heat of Formation -424.1 ± 16.7 kJ·mol−1
Dipole Moment 9.67 ± 1.08 D
Volume 414.54 Å 3
Surface Area 365.49 Å 2
HOMO Energy -10.01 ± 0.55 eV
LUMO Energy -1.55 ± eV
Point Group Symmetry C1
InChIKey JSEWSIQDZSHVQW-UHFFFAOYSA-N
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Elements H C N O Cl