Formula |
C26H25F2N3O6 |
IUPAC Name |
(3s)-5-(2,6-difluorophenoxy)-3-[[(2s)-3-methyl-2-(quinoline-2-carbonylamino)butanoyl]amino]-4-oxo-pentanoic acid |
Molecular Mass |
513.490 g·mol−1 |
Heat of Formation |
-1175.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
9.90 ± 1.08 D |
Volume |
604.75 Å 3 |
Surface Area |
443.39 Å 2 |
HOMO Energy |
-9.72 ± 0.55 eV |
LUMO Energy |
-1.52 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
OOBJCYKITXPCNS-REWPJTCUSA-N |
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Elements |
H
C
N
O
F
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