Lersivirine

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Properties Simple | Detailed

Formula C17H18N4O2
IUPAC Name 5-[3,5-diethyl-1-(2-hydroxyethyl)pyrazol-4-yl]oxybenzene-1,3-dicarbonitrile
Molecular Mass 310.350 g·mol−1
Heat of Formation 113.0 ± 16.7 kJ·mol−1
Dipole Moment 4.33 ± 1.08 D
Volume 388.59 Å 3
Surface Area 341.71 Å 2
HOMO Energy -9.77 ± 0.55 eV
LUMO Energy -1.41 ± eV
Point Group Symmetry C1
Synonyms
  • 5-[3,5-diethyl-1-(2-hydroxyethyl)pyrazol-4-yl]oxyisophthalonitrile
  • 5-[[3,5-diethyl-1-(2-hydroxyethyl)-4-pyrazolyl]oxy]benzene-1,3-dicarbonitrile
InChIKey MCPUZZJBAHRIPO-UHFFFAOYSA-N
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