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

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Properties Simple | Detailed

Formula C10H9NO3S
IUPAC Name (2e,4r)-2-(6-oxocyclohexa-2,4-dien-1-ylidene)thiazolidine-4-carboxylic acid
Molecular Mass 223.248 g·mol−1
Heat of Formation -343.0 ± 16.7 kJ·mol−1
Dipole Moment 5.22 ± 1.08 D
Volume 242.76 Å 3
Surface Area 227.14 Å 2
HOMO Energy -8.48 ± 0.55 eV
LUMO Energy -1.21 ± eV
Point Group Symmetry C1
InChIKey QIAOTLJJULDKAX-QCCBYXMRSA-N
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