8-((3-(4-(2-Methoxyphenyl)Piperazin-1-Yl)-2-Hydroxypropyl)Oxy)Thiochroman
Properties
Property | Value |
---|---|
Formula | C23H30N2O3S |
IUPAC Name | (2r)-1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-thiochroman-8-yloxy-propan-2-ol |
Molecular Mass | 414.561 g·mol−1 |
Heat of Formation | -322.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 1.79 ± 1.08 D |
Volume | 502.66 Å 3 |
Surface Area | 372.83 Å 2 |
HOMO Energy | -7.99 ± 0.55 eV |
LUMO Energy | 0.07 ± eV |
Point Group Symmetry | C1 |
InChIKey | RDNYUUKCLYBVFN-LJQANCHMSA-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 |