Formula |
C25H34F3N5O2 |
IUPAC Name |
(3r,5s)-4-[[2-methyl-2-[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]propanoyl]amino]adamantane-1-carboxamide |
Molecular Mass |
493.565 g·mol−1 |
Heat of Formation |
-1046.8 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.86 ± 1.08 D |
Volume |
574.79 Å 3 |
Surface Area |
439.3 Å 2 |
HOMO Energy |
-9.27 ± 0.55 eV |
LUMO Energy |
2.14 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
CLHMYBJIOZXCEX-YVTWMXDDSA-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
|
|
|