N-({(5S)-3-[4-(4-Cyano-1H-Pyrazol-1-Yl)-3-Fluorophenyl]-2-Oxo-1,3-Oxazolidin-5-Yl}Methyl)Acetamide

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Formula C16H14FN5O3
IUPAC Name n-[[(5s)-3-[4-(4-cyanopyrazol-1-yl)-3-fluoro-phenyl]-2-oxo-oxazolidin-5-yl]methyl]acetamide
Molecular Mass 343.312 g·mol−1
Heat of Formation -256.3 ± 16.7 kJ·mol−1
Dipole Moment 7.39 ± 1.08 D
Volume 377.61 Å 3
Surface Area 351.65 Å 2
HOMO Energy -9.22 ± 0.55 eV
LUMO Energy -1.34 ± eV
Point Group Symmetry C1
Synonyms
  • n-[[(5s)-3-[4-(4-cyanopyrazol-1-yl)-3-fluoro-phenyl]-2-keto-oxazolidin-5-yl]methyl]acetamide
  • n-[[(5s)-3-[4-(4-cyanopyrazol-1-yl)-3-fluoro-phenyl]-2-oxo-oxazolidin-5-yl]methyl]acetamide
InChIKey CNKRAEIVSKYEGR-ZDUSSCGKSA-N
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