4,5-Bis(Hydroxymethyl)-2-Methyl-3-Pyridinyl 3-Acetyl-1,3-Thiazolidine-2-Carboxylate
Properties
Property | Value |
---|---|
Formula | C14H18N2O5S |
IUPAC Name | [4,5-bis(hydroxymethyl)-2-methyl-3-pyridyl] (2r)-3-acetylthiazolidine-2-carboxylate |
Molecular Mass | 326.368 g·mol−1 |
Heat of Formation | -798.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.37 ± 1.08 D |
Volume | 369.7 Å 3 |
Surface Area | 311.78 Å 2 |
HOMO Energy | -9.24 ± 0.55 eV |
LUMO Energy | -0.88 ± eV |
Point Group Symmetry | C1 |
InChIKey | VGNNZGLPSPBMAI-CYBMUJFWSA-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 |