Formula |
C34H39Cl3N4O3 |
IUPAC Name |
(3r,4s)-n-[[2-chloro-5-[(cyclopropylamino)methyl]phenyl]methyl]-n-cyclopropyl-4-[6-[2-(2,6-dichloro-4-methyl-phenoxy)ethoxy]-3-pyridyl]piperidine-3-carboxamide |
Molecular Mass |
658.057 g·mol−1 |
Heat of Formation |
-253.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.05 ± 1.08 D |
Volume |
760.63 Å 3 |
Surface Area |
524.55 Å 2 |
HOMO Energy |
-8.88 ± 0.55 eV |
LUMO Energy |
2.69 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
MUNGQQYSICIEKG-IZLXSDGUSA-N |
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Elements |
H
C
Cl
O
N
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