| Formula |
C19H23ClN8 |
| IUPAC Name |
4-(5-chloro-3-isopropyl-pyrazol-1-ium-2-id-4-yl)-n-(5-piperazin-1-yl-2-pyridyl)pyrimidin-2-amine |
| Molecular Mass |
398.893 g·mol−1 |
| Heat of Formation |
448.0 ± 16.7 kJ·mol−1 |
| Dipole Moment |
4.23 ± 1.08 D |
| Volume |
463.15 Å 3 |
| Surface Area |
406.91 Å 2 |
| HOMO Energy |
-8.38 ± 0.55 eV |
| LUMO Energy |
1.29 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
ZGJLAVYYTJNBMN-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
Cl
N
|
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