| Formula |
C23H22N8O |
| IUPAC Name |
2-[(1s)-1-[(2-amino-7h-purine-1,3,9-triium-5-id-6-yl)amino]ethyl]-5-methyl-3-(o-tolyl)quinazolin-1-ium-4a-id-4-one |
| Molecular Mass |
426.474 g·mol−1 |
| Heat of Formation |
314.9 ± 16.7 kJ·mol−1 |
| Dipole Moment |
5.08 ± 1.08 D |
| Volume |
500.23 Å 3 |
| Surface Area |
399.81 Å 2 |
| HOMO Energy |
-8.57 ± 0.55 eV |
| LUMO Energy |
-0.99 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
PUYVJBBSBPUKBT-AWEZNQCLSA-N |
| QR Code |
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| Links |
PubChem
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|
| DOI |
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| Downloads |
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|
| Elements |
H
C
O
N
|
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