(2R)-5-(Acetoxymethyl)-2-{(1R)-2-Oxo-1-[(2-Thienylacetyl)Amino]Ethyl}-3,6-Dihydro-2H-1,3-Thiazine-4-Carboxylic Acid

Molecule SVG Image

Properties Simple | Detailed

Formula C16H18N2O6S2
IUPAC Name (2r)-5-(acetoxymethyl)-2-[(1r)-2-oxo-1-[[2-(2-thienyl)acetyl]amino]ethyl]-3,6-dihydro-2h-1,3-thiazine-4-carboxylic acid
Molecular Mass 398.454 g·mol−1
Heat of Formation -837.9 ± 16.7 kJ·mol−1
Dipole Moment 3.70 ± 1.08 D
Volume 442.07 Å 3
Surface Area 389.08 Å 2
HOMO Energy -8.98 ± 0.55 eV
LUMO Energy -0.71 ± eV
Point Group Symmetry C1
InChIKey MXSQWXIVWHYOCY-IUODEOHRSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C S O N