Formula |
C33H45N7O2 |
IUPAC Name |
4-[5-(4-tert-butylpiperazin-1-yl)-2-pyridyl]-n-[(1r,3s)-5-carbamoyl-2-adamantyl]-2,3-dihydroquinoxaline-1-carboxamide |
Molecular Mass |
571.756 g·mol−1 |
Heat of Formation |
-182.6 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.64 ± 1.08 D |
Volume |
699.52 Å 3 |
Surface Area |
564.07 Å 2 |
HOMO Energy |
-7.90 ± 0.55 eV |
LUMO Energy |
2.81 ± eV |
Point Group Symmetry |
C1
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InChIKey |
RZUKTDWPBQOSBE-PKZLOJIYSA-N |
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Links |
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Elements |
H
C
O
N
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