2-Chloro-3'-Fluoro-3-[(E)-(Hydroxyimino)Methyl]-4,4'-Biphenyldiol

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Properties Simple | Detailed

Formula C13H9ClFNO3
IUPAC Name (1e)-2-chloro-3-(3-fluoro-4-hydroxy-phenyl)-6-hydroxy-benzaldehyde oxime
Molecular Mass 281.667 g·mol−1
Heat of Formation -431.4 ± 16.7 kJ·mol−1
Dipole Moment 1.15 ± 1.08 D
Volume 291.2 Å 3
Surface Area 269.7 Å 2
HOMO Energy -9.23 ± 0.55 eV
LUMO Energy -1.04 ± eV
Point Group Symmetry C1
InChIKey CWBFECUIDZXHBY-OMCISZLKSA-N
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Elements C Cl H F O N