| Formula |
C24H22FN5O2 |
| IUPAC Name |
(6e)-6-[(6s)-2-(4-fluorophenyl)-6-(hydroxymethyl)-6,7-dihydro-5h-pyrazolo[1,5-a]pyrimidin-3-ylidene]-2-(o-tolyl)-1h-pyridazin-3-one |
| Molecular Mass |
431.462 g·mol−1 |
| Heat of Formation |
101.8 ± 16.7 kJ·mol−1 |
| Dipole Moment |
1.69 ± 1.08 D |
| Volume |
502.68 Å 3 |
| Surface Area |
391.17 Å 2 |
| HOMO Energy |
-8.38 ± 0.55 eV |
| LUMO Energy |
1.51 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
LKQIFMKIEJDTEJ-QKDOTCOFSA-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
N
O
F
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