| Formula |
C20H28N8O2S |
| IUPAC Name |
n-(2-aminoethyl)-n-[5-[(1-cycloheptylpyrazolo[3,4-d]pyrimidin-1-ium-6-ylium-6-yl)amino]-2-pyridyl]methanesulfonamide |
| Molecular Mass |
444.554 g·mol−1 |
| Heat of Formation |
54.2 ± 16.7 kJ·mol−1 |
| Dipole Moment |
1.64 ± 1.08 D |
| Volume |
514.44 Å 3 |
| Surface Area |
444.87 Å 2 |
| HOMO Energy |
-8.37 ± 0.55 eV |
| LUMO Energy |
-0.93 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
SZKRTTIHILIRKD-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
S
C
O
N
|
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