| Formula |
C22H26ClN3O5 |
| IUPAC Name |
benzyl n-[2-[[2-[[(1s,2r)-1-benzyl-3-chloro-2-hydroxy-propyl]amino]-2-oxo-ethyl]amino]-2-oxo-ethyl]carbamate |
| Molecular Mass |
447.912 g·mol−1 |
| Heat of Formation |
-800.5 ± 16.7 kJ·mol−1 |
| Dipole Moment |
5.42 ± 1.08 D |
| Volume |
529.54 Å 3 |
| Surface Area |
472.72 Å 2 |
| HOMO Energy |
-9.80 ± 0.55 eV |
| LUMO Energy |
-0.25 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
WLEADEPGUSFGIL-OALUTQOASA-N |
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| DOI |
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| Elements |
H
C
Cl
O
N
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