| Formula |
C22H22FN5O3S |
| IUPAC Name |
3-[(1r)-1-[2-(1,3-dihydrotriazol-2-yl)-5-fluoro-phenyl]ethoxy]-5-(3-methylsulfonylphenyl)pyridin-2-amine |
| Molecular Mass |
455.505 g·mol−1 |
| Heat of Formation |
-126.1 ± 16.7 kJ·mol−1 |
| Dipole Moment |
9.61 ± 1.08 D |
| Volume |
509.7 Å 3 |
| Surface Area |
408.77 Å 2 |
| HOMO Energy |
-8.53 ± 0.55 eV |
| LUMO Energy |
2.24 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
CNOPXBIRDNNWIV-CQSZACIVSA-N |
| QR Code |
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| Links |
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| DOI |
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| Downloads |
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|
| Elements |
C
F
H
O
N
S
|
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