Ethyl (2S,3R)-3-Ethyl-1-[(4-Nitrophenyl)Sulfonyl]-4-Oxo-2-Azetidinecarboxylate

Molecule SVG Image

Properties Simple | Detailed

Formula C14H16N2O7S
IUPAC Name ethyl (2s,3r)-3-ethyl-1-(4-nitrophenyl)sulfonyl-4-oxo-azetidine-2-carboxylate
Molecular Mass 356.351 g·mol−1
Heat of Formation -748.0 ± 16.7 kJ·mol−1
Dipole Moment 3.46 ± 1.08 D
Volume 388.24 Å 3
Surface Area 322.88 Å 2
HOMO Energy -10.68 ± 0.55 eV
LUMO Energy -1.98 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,3r)-3-ethyl-1-(4-nitrophenyl)sulfonyl-4-oxo-2-azetidinecarboxylic acid ethyl ester
  • (2s,3r)-3-ethyl-4-keto-1-(4-nitrophenyl)sulfonyl-azetidine-2-carboxylic acid ethyl ester
  • ethyl (2s,3r)-3-ethyl-1-(4-nitrophenyl)sulfonyl-4-oxo-azetidine-2-carboxylate
  • ethyl (2s,3r)-3-ethyl-1-(4-nitrophenyl)sulfonyl-4-oxoazetidine-2-carboxylate
InChIKey FYFRVXKQSCCYAE-NEPJUHHUSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H S C O N