Deacetyldiltiazem
Properties
Property | Value |
---|---|
Formula | C20H24N2O3S |
IUPAC Name | (2s,3r)-5-[2-(dimethylamino)ethyl]-3-hydroxy-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one |
Molecular Mass | 372.481 g·mol−1 |
Heat of Formation | -316.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.85 ± 1.08 D |
Volume | 448.67 Å 3 |
Surface Area | 375.5 Å 2 |
HOMO Energy | -8.67 ± 0.55 eV |
LUMO Energy | -0.80 ± eV |
Point Group Symmetry | C1 |
InChIKey | NZHUXMZTSSZXSB-OALUTQOASA-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 |