Formula |
C20H23ClN4O2 |
IUPAC Name |
(2s)-1-[(2r)-2-amino-3-phenyl-propanoyl]-n-[(4-chloro-2-pyridyl)methyl]pyrrolidine-2-carboxamide |
Molecular Mass |
386.875 g·mol−1 |
Heat of Formation |
-194.8 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.07 ± 1.08 D |
Volume |
459.22 Å 3 |
Surface Area |
399.74 Å 2 |
HOMO Energy |
-9.57 ± 0.55 eV |
LUMO Energy |
-0.55 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
HLPBLACQLHRYRL-MSOLQXFVSA-N |
QR Code |
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Links |
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Elements |
H
C
Cl
O
N
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