{2-[(4-Bromo-2,3,5,6-Tetrafluorobenzyl)Carbamoyl]-5-Chlorophenoxy}Acetic Acid

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Properties Simple | Detailed

Formula C16H9BrClF4NO4
IUPAC Name 2-[2-[(4-bromo-2,3,5,6-tetrafluoro-phenyl)methylcarbamoyl]-5-chloro-phenoxy]acetic acid
Molecular Mass 470.598 g·mol−1
Heat of Formation -1281.6 ± 16.7 kJ·mol−1
Dipole Moment 3.94 ± 1.08 D
Volume 418.1 Å 3
Surface Area 340.05 Å 2
HOMO Energy -9.88 ± 0.55 eV
LUMO Energy 1.64 ± eV
Point Group Symmetry C1
InChIKey KHMHPWZCDNMQKJ-UHFFFAOYSA-N
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Elements C F H Cl O N Br