3-Chloro-6-Hydroxy-2-Oxo-3,5-Hexadienoic Acid

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Properties Simple | Detailed

Formula C6H5ClO4
IUPAC Name (3z,5e)-3-chloro-6-hydroxy-2-oxo-hexa-3,5-dienoic acid
Molecular Mass 176.554 g·mol−1
Heat of Formation -579.4 ± 16.7 kJ·mol−1
Dipole Moment 5.11 ± 1.08 D
Volume 184.83 Å 3
Surface Area 190.08 Å 2
HOMO Energy -9.46 ± 0.55 eV
LUMO Energy 1.75 ± eV
Point Group Symmetry C1
InChIKey ARNPHMFDLAFXDI-TZFCGSKZSA-N
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Elements H C O Cl