Formula |
C21H21FN2O3 |
IUPAC Name |
(6s)-6-[[4-(6-fluoro-1,2-benzoxazol-3-yl)-1-piperidyl]methyl]-6,7-dihydro-5h-benzofuran-4-one |
Molecular Mass |
368.401 g·mol−1 |
Heat of Formation |
-253.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
7.71 ± 1.08 D |
Volume |
426.58 Å 3 |
Surface Area |
374.04 Å 2 |
HOMO Energy |
-9.19 ± 0.55 eV |
LUMO Energy |
-0.95 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
RJXYBXCQVVCCAR-CYBMUJFWSA-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
|
|
|