1-[4-(3-Chlorophenyl)-1-Piperazinyl]-4-Sulfanyl-1-Butanone
Properties
Property | Value |
---|---|
Formula | C14H19ClN2OS |
IUPAC Name | 1-[4-(3-chlorophenyl)piperazin-1-yl]-4-sulfanyl-butan-1-one |
Molecular Mass | 298.831 g·mol−1 |
Heat of Formation | -123.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.18 ± 1.08 D |
Volume | 354.34 Å 3 |
Surface Area | 320.51 Å 2 |
HOMO Energy | -8.80 ± 0.55 eV |
LUMO Energy | 2.69 ± eV |
Point Group Symmetry | C1 |
InChIKey | ZRDBMFDEDKLQCF-UHFFFAOYSA-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 |