(5R)-2,5,6,7-Tetrahydro-1,4-Thiazepine-3,5-Dicarboxylic Acid
Properties
Property | Value |
---|---|
Formula | C7H9NO4S |
IUPAC Name | (5s)-2,5,6,7-tetrahydro-1,4-thiazepine-3,5-dicarboxylic acid |
Molecular Mass | 203.216 g·mol−1 |
Heat of Formation | -648.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.50 ± 1.08 D |
Volume | 220.77 Å 3 |
Surface Area | 209.2 Å 2 |
HOMO Energy | -9.14 ± 0.55 eV |
LUMO Energy | -0.91 ± eV |
Point Group Symmetry | C1 |
InChIKey | XJUQJVUYGRTQGI-BYPYZUCNSA-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 |