Formula |
C27H31N3 |
IUPAC Name |
6-[(1s,2s)-2-[(1r)-1-isopropyl-2-methyl-3,4-dihydro-1h-isoquinolin-7-yl]cyclopropyl]naphthalene-2-carboxamidine |
Molecular Mass |
397.555 g·mol−1 |
Heat of Formation |
312.9 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.77 ± 1.08 D |
Volume |
515.11 Å 3 |
Surface Area |
433.94 Å 2 |
HOMO Energy |
-8.81 ± 0.55 eV |
LUMO Energy |
2.32 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
FEPIUXBUJVISNN-DGWZTRNLSA-N |
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Elements |
H
C
N
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