[(1S)-1-(5-Chloro-1-Benzothiophen-3-Yl)-2-{[(E)-2-(3,4-Difluorophenyl)Vinyl]Amino}-2-Oxoethyl]Methylphosphinic Acid

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Properties Simple | Detailed

Formula C19H15ClF2NO3PS
IUPAC Name [(1s)-1-(5-chlorobenzothiophen-3-yl)-2-[[(e)-2-(3,4-difluorophenyl)vinyl]amino]-2-oxo-ethyl]-methyl-phosphinic acid
Molecular Mass 441.816 g·mol−1
Heat of Formation -839.0 ± 16.7 kJ·mol−1
Dipole Moment 5.53 ± 1.08 D
Volume 470.59 Å 3
Surface Area 412.65 Å 2
HOMO Energy -8.92 ± 0.55 eV
LUMO Energy 1.86 ± eV
Point Group Symmetry C1
InChIKey SEXLHAASDZPHOM-DKFQHHCZSA-N
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Elements C F H Cl O N P S