3,6-Dihydro-2H-1,4-Thiazine-3,5-Dicarboxylic Acid
Properties
Property | Value |
---|---|
Formula | C6H7NO4S |
IUPAC Name | (3r)-3,6-dihydro-2h-1,4-thiazine-3,5-dicarboxylic acid |
Molecular Mass | 189.189 g·mol−1 |
Heat of Formation | -629.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.36 ± 1.08 D |
Volume | 201.07 Å 3 |
Surface Area | 196.04 Å 2 |
HOMO Energy | -9.25 ± 0.55 eV |
LUMO Energy | -0.98 ± eV |
Point Group Symmetry | C1 |
InChIKey | XIVVIYYWXOMYOD-VKHMYHEASA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H S C O N |