| Formula |
C28H26ClF2N3OS |
| IUPAC Name |
3-chloro-4,7-difluoro-n-[4-(methylamino)cyclohexyl]-n-[[3-(4-pyridyl)phenyl]methyl]benzothiophene-2-carboxamide |
| Molecular Mass |
526.040 g·mol−1 |
| Heat of Formation |
-259.9 ± 16.7 kJ·mol−1 |
| Dipole Moment |
5.56 ± 1.08 D |
| Volume |
595.15 Å 3 |
| Surface Area |
475.03 Å 2 |
| HOMO Energy |
-8.93 ± 0.55 eV |
| LUMO Energy |
1.47 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
RXZDWPYJFCAZCW-MEMLXQNLSA-N |
| QR Code |
Generate QR Code |
| Links |
ChemSpider
|
| DOI |
|
| Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
| Elements |
C
F
H
Cl
O
N
S
|
| |
|
