| Formula |
C23H22N7O3+ |
| IUPAC Name |
3-[5-acetamido-3-[3-cyano-7-(cyclopropylamino)-1h-pyrazolo[1,5-a]pyrimidin-8-ium-5-yl]indol-1-yl]propanoic acid |
| Molecular Mass |
444.466 g·mol−1 |
| Heat of Formation |
132.6 ± 16.7 kJ·mol−1 |
| Dipole Moment |
8.55 ± 1.08 D |
| Volume |
520.86 Å 3 |
| Surface Area |
450.77 Å 2 |
| HOMO Energy |
-8.30 ± 0.55 eV |
| LUMO Energy |
2.02 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
FHNQKCCNLSMQSH-UHFFFAOYSA-O |
| QR Code |
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| Links |
PubChem
|
| DOI |
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| Downloads |
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|
| Elements |
H
C
O
N
|
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