Formula |
C17H29N3O3 |
IUPAC Name |
(2r)-4-(4-aminocyclohexa-2,5-dien-1-yl)-2-[[(2r,3r)-3-methyl-2-(methylamino)pentanoyl]amino]butanoic acid |
Molecular Mass |
323.430 g·mol−1 |
Heat of Formation |
-541.8 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.99 ± 1.08 D |
Volume |
428.3 Å 3 |
Surface Area |
354.37 Å 2 |
HOMO Energy |
-9.21 ± 0.55 eV |
LUMO Energy |
0.74 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
ATAHFPOIIFBWFN-ZSAUSMIDSA-N |
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Elements |
H
C
O
N
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