Formula |
C30H37N3O4 |
IUPAC Name |
(z)-n-[(s)-benzyl-[(2s,3s)-3-(1,1-dimethylethoxycarbonylamino)-2-hydroxy-4-phenyl-butyl]-methyl-ammonio]benzenecarboximidate |
Molecular Mass |
503.632 g·mol−1 |
Heat of Formation |
-482.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.14 ± 1.08 D |
Volume |
635.13 Å 3 |
Surface Area |
482.51 Å 2 |
HOMO Energy |
-8.97 ± 0.55 eV |
LUMO Energy |
-0.43 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
KTCIZECZUWZDHY-OEYLZLLESA-O |
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Elements |
H
C
O
N
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