[(1S)-1-(5-Chloro-1-Benzothiophen-3-Yl)-2-(2-Naphthylamino)-2-Oxoethyl]Phosphonic Acid

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Properties Simple | Detailed

Formula C20H15ClNO4PS
IUPAC Name [(1s)-1-(5-chlorobenzothiophen-3-yl)-2-(2-naphthylamino)-2-oxo-ethyl]phosphonic acid
Molecular Mass 431.829 g·mol−1
Heat of Formation -684.2 ± 16.7 kJ·mol−1
Dipole Moment 2.72 ± 1.08 D
Volume 456.98 Å 3
Surface Area 396.06 Å 2
HOMO Energy -8.59 ± 0.55 eV
LUMO Energy 3.19 ± eV
Point Group Symmetry C1
Synonyms
  • [(1s)-1-(5-chloro-1-benzothiophen-3-yl)-2-(naphthalen-2-ylamino)-2-oxo-ethyl]phosphonic acid
  • [(1s)-1-(5-chloro-1-benzothiophen-3-yl)-2-(naphthalen-2-ylamino)-2-oxoethyl]phosphonic acid
  • [(1s)-1-(5-chloro-3-benzothiophenyl)-2-(2-naphthylamino)-2-oxoethyl]phosphonic acid
  • [(1s)-1-(5-chlorobenzothiophen-3-yl)-2-(2-naphthylamino)-2-oxo-ethyl]phosphonic acid
  • [(1s)-1-(5-chlorobenzothiophen-3-yl)-2-keto-2-(2-naphthylamino)ethyl]phosphonic acid
  • drx
InChIKey HUJXISJLAPAFBO-IBGZPJMESA-N
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Elements C Cl H O N P S