| Formula |
C32H29FN4O2 |
| IUPAC Name |
[7-benzyl-2-(5-fluoro-2-methyl-phenoxy)-1-phenyl-pyrrolo[2,3-c]pyridin-1-ium-7-ylium-3-yl]-piperazin-1-yl-methanone |
| Molecular Mass |
520.597 g·mol−1 |
| Heat of Formation |
-35.5 ± 16.7 kJ·mol−1 |
| Dipole Moment |
6.05 ± 1.08 D |
| Volume |
626.09 Å 3 |
| Surface Area |
441.41 Å 2 |
| HOMO Energy |
-8.70 ± 0.55 eV |
| LUMO Energy |
2.30 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
UIBPLELQTBSRIZ-UHFFFAOYSA-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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