2H-1,2-Benzothiazine-2-Acetic Acid, 3-Carboxy-4-Hydroxy-, Diethyl Ester, 1,1-Dioxide
Properties
Property | Value |
---|---|
Formula | C15H17NO7S |
IUPAC Name | ethyl (2s)-2-(2-ethoxy-2-oxo-ethyl)-4-hydroxy-1,1-dioxo-1λ6,2-benzothiazine-3-carboxylate |
Molecular Mass | 355.363 g·mol−1 |
Heat of Formation | -1088.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.83 ± 1.08 D |
Volume | 381.04 Å 3 |
Surface Area | 320.06 Å 2 |
HOMO Energy | -8.70 ± 0.55 eV |
LUMO Energy | -1.29 ± eV |
Point Group Symmetry | C1 |
InChIKey | BPELUZYRFHIQNA-UHFFFAOYSA-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 |