N-[(1S,2S)-1,3-Dihydroxy-1-(4-Nitrophenyl)-2-Propanyl]Acetamide

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Properties Simple | Detailed

Formula C11H14N2O5
IUPAC Name n-[(1s,2s)-1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]acetamide
Molecular Mass 254.239 g·mol−1
Heat of Formation 1290.5 ± 16.7 kJ·mol−1
Dipole Moment 2.01 ± 1.08 D
Volume 252.83 Å 3
Surface Area 244.65 Å 2
HOMO Energy -10.09 ± 0.55 eV
LUMO Energy -3.19 ± eV
Point Group Symmetry C1
Synonyms
  • n-[(1s,2s)-1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]acetamide
  • n-[(1s,2s)-1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]ethanamide
  • n-[(1s,2s)-2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl]acetamide
  • n-[(1s,2s)-2-hydroxy-1-methylol-2-(4-nitrophenyl)ethyl]acetamide
  • zinc00174040
InChIKey PIVQDUYOEIAFDM-QWRGUYRKSA-N
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