| Formula |
C31H29FN6O4S2 |
| IUPAC Name |
2-fluoro-n-[(1r)-1-(indol-1-ium-3-ylmethyl)-2-oxo-2-(4-pyridylamino)ethyl]-4-[4-(2-thienylsulfonyl)piperazin-1-yl]benzamide |
| Molecular Mass |
632.728 g·mol−1 |
| Heat of Formation |
-352.9 ± 16.7 kJ·mol−1 |
| Dipole Moment |
9.26 ± 1.08 D |
| Volume |
702.8 Å 3 |
| Surface Area |
559.13 Å 2 |
| HOMO Energy |
-8.79 ± 0.55 eV |
| LUMO Energy |
-1.56 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
NWMLUXULVUDWBD-MUUNZHRXSA-N |
| QR Code |
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| Links |
PubChem
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| DOI |
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| Downloads |
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|
| Elements |
C
F
H
O
N
S
|
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