3-Oxo-3,4-Dihydro-2H-1,4-Benzothiazine-7-Carboxylic Acid
Properties
Property | Value |
---|---|
Formula | C9H7NO3S |
IUPAC Name | 3-oxo-4h-1,4-benzothiazine-7-carboxylic acid |
Molecular Mass | 209.222 g·mol−1 |
Heat of Formation | -440.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.28 ± 1.08 D |
Volume | 220.74 Å 3 |
Surface Area | 211.71 Å 2 |
HOMO Energy | -8.89 ± 0.55 eV |
LUMO Energy | 1.82 ± eV |
Point Group Symmetry | C1 |
InChIKey | PMIQHWMFUZMWOX-UHFFFAOYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C S O N |