Formula |
C26H31N3O5 |
IUPAC Name |
5-(2,4-dihydroxy-5-isopropyl-phenyl)-n-ethyl-4-[4-(morpholinomethyl)phenyl]isoxazole-3-carboxamide |
Molecular Mass |
465.541 g·mol−1 |
Heat of Formation |
-545.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.14 ± 1.08 D |
Volume |
567.88 Å 3 |
Surface Area |
460.71 Å 2 |
HOMO Energy |
-9.00 ± 0.55 eV |
LUMO Energy |
2.14 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
NDAZATDQFDPQBD-UHFFFAOYSA-N |
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Elements |
H
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