4-Acetyl-5-Cyano-3-Thioxo-2-Morpholinecarboxylic Acid

Molecule SVG Image

Properties Simple | Detailed

Formula C8H8N2O4S
IUPAC Name (2r,5s)-4-acetyl-5-cyano-3-thioxo-morpholine-2-carboxylic acid
Molecular Mass 228.225 g·mol−1
Heat of Formation -456.2 ± 16.7 kJ·mol−1
Dipole Moment 4.54 ± 1.08 D
Volume 246.41 Å 3
Surface Area 221.96 Å 2
HOMO Energy -9.38 ± 0.55 eV
LUMO Energy 1.22 ± eV
Point Group Symmetry C1
InChIKey HJRFYKCNCXAIPA-WDSKDSINSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H S C O N