6-{[4-(4-Fluorobenzoyl)-1-Piperidinyl]Methyl}-6,7-Dihydro-1-Benzofuran-4(5H)-One
Properties
Property | Value |
---|---|
Formula | C21H22FNO3 |
IUPAC Name | (6s)-6-[[4-(4-fluorobenzoyl)-1-piperidyl]methyl]-6,7-dihydro-5h-benzofuran-4-one |
Molecular Mass | 355.403 g·mol−1 |
Heat of Formation | -456.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.88 ± 1.08 D |
Volume | 422.27 Å 3 |
Surface Area | 368.18 Å 2 |
HOMO Energy | -9.19 ± 0.55 eV |
LUMO Energy | -0.79 ± eV |
Point Group Symmetry | C1 |
InChIKey | XFBPGUPMMWBWAS-CQSZACIVSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C N O F |