(3S)-3-Ammonio-3-(2-Nitrophenyl)Propanoate

Molecule SVG Image

Properties Simple | Detailed

Formula C9H10N2O4
IUPAC Name (3s)-3-azaniumyl-3-(2-nitrophenyl)propanoate
Molecular Mass 210.187 g·mol−1
Heat of Formation 1336.8 ± 16.7 kJ·mol−1
Dipole Moment 4.79 ± 1.08 D
Volume 218.1 Å 3
Surface Area 216.08 Å 2
HOMO Energy -10.96 ± 0.55 eV
LUMO Energy -0.70 ± eV
Point Group Symmetry C1
Synonyms
  • (3s)-3-ammonio-3-(2-nitrophenyl)propanoate
  • (3s)-3-ammonio-3-(2-nitrophenyl)propionate
  • (3s)-3-azaniumyl-3-(2-nitrophenyl)propanoate
  • zinc00161426
InChIKey XXBOYULKNZTOMN-ZETCQYMHSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements C O N