| Formula |
C33H29F3N6O2 |
| IUPAC Name |
4-[4-(3,4-difluorophenyl)piperazin-1-yl]-2-fluoro-n-[(1r)-1-(indol-1-ium-3-ylmethyl)-2-oxo-2-(4-pyridylamino)ethyl]benzamide |
| Molecular Mass |
598.618 g·mol−1 |
| Heat of Formation |
-373.1 ± 16.7 kJ·mol−1 |
| Dipole Moment |
8.37 ± 1.08 D |
| Volume |
682.07 Å 3 |
| Surface Area |
577.0 Å 2 |
| HOMO Energy |
-8.70 ± 0.55 eV |
| LUMO Energy |
-0.69 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
UJJHTUJDTNONGY-WJOKGBTCSA-N |
| QR Code |
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| Links |
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| DOI |
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| Downloads |
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|
| Elements |
H
C
F
O
N
|
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