5-{[2-Chloro(~2~H_4_)Phenyl]Methyl}-5,6,7,7A-Tetrahydrothieno[3,2-C]Pyridin-2(4H)-One
Properties
Property | Value |
---|---|
Formula | C14H14ClNOS |
IUPAC Name | (7ar)-5-[(2-chlorophenyl)methyl]-4,6,7,7a-tetrahydrothieno[3,2-c]pyridin-2-one |
Molecular Mass | 279.785 g·mol−1 |
Heat of Formation | -6.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.94 ± 1.08 D |
Volume | 321.42 Å 3 |
Surface Area | 275.13 Å 2 |
HOMO Energy | -9.12 ± 0.55 eV |
LUMO Energy | 2.43 ± eV |
Point Group Symmetry | C1 |
InChIKey | DJZQIXWGIZIETJ-CYBMUJFWSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | C Cl H O N S |