(2S,2'E,4'R)-3,4-Dimethyl-2'-(6-Oxo-2,4-Cyclohexadien-1-Ylidene)-2,4'-Bi-1,3-Thiazolidine-4-Carboxylic Acid

Molecule SVG Image

Properties Simple | Detailed

Formula C15H18N2O3S2
IUPAC Name (2s,3r,4s)-3,4-dimethyl-2-[(2e,4s)-2-(6-oxocyclohexa-2,4-dien-1-ylidene)thiazolidin-4-yl]thiazolidine-4-carboxylic acid
Molecular Mass 338.445 g·mol−1
Heat of Formation -349.0 ± 16.7 kJ·mol−1
Dipole Moment 5.44 ± 1.08 D
Volume 378.91 Å 3
Surface Area 313.14 Å 2
HOMO Energy -8.21 ± 0.55 eV
LUMO Energy -0.84 ± eV
Point Group Symmetry C1
InChIKey HIKAKPGMRFRQTC-ZQXUOAGUSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H S C O N