3,5-Dichloro-N-{[(2S)-1-(2-Fluoroethyl)-2-Pyrrolidinyl]Methyl}-2-Hydroxy-6-Methoxybenzamide

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Properties Simple | Detailed

Formula C15H19Cl2FN2O3
IUPAC Name 3,5-dichloro-n-[[(1s,2s)-1-(2-fluoroethyl)pyrrolidin-2-yl]methyl]-2-hydroxy-6-methoxy-benzamide
Molecular Mass 365.227 g·mol−1
Heat of Formation -699.1 ± 16.7 kJ·mol−1
Dipole Moment 3.41 ± 1.08 D
Volume 409.13 Å 3
Surface Area 346.52 Å 2
HOMO Energy -9.03 ± 0.55 eV
LUMO Energy -1.02 ± eV
Point Group Symmetry C1
Synonyms
  • 3,5-dichloro-n-[[(2s)-1-(2-fluoroethyl)-2-pyrrolidinyl]methyl]-2-hydroxy-6-methoxybenzamide
  • 3,5-dichloro-n-[[(2s)-1-(2-fluoroethyl)pyrrolidin-2-yl]methyl]-2-hydroxy-6-methoxy-benzamide
  • 3,5-dichloro-n-[[(2s)-1-(2-fluoroethyl)pyrrolidin-2-yl]methyl]-2-hydroxy-6-methoxybenzamide
InChIKey SUMSSRZHRHBCGI-VIFPVBQESA-N
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Elements C F H Cl O N