| Formula |
C20H26N6O3+ |
| IUPAC Name |
(2r)-2-[(1-cyclopentyl-4-oxo-7h-pyrazolo[3,4-d]pyrimidine-1,5-diium-2-id-6-yl)amino]-n-(4-methoxyphenyl)propanamide |
| Molecular Mass |
398.459 g·mol−1 |
| Heat of Formation |
-140.9 ± 16.7 kJ·mol−1 |
| Dipole Moment |
7.49 ± 1.08 D |
| Volume |
465.92 Å 3 |
| Surface Area |
423.56 Å 2 |
| HOMO Energy |
-8.64 ± 0.55 eV |
| LUMO Energy |
-0.42 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
TWOXXEVXHSYYHT-GFCCVEGCSA-P |
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| DOI |
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|
| Elements |
H
C
O
N
|
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