Formula |
C18H25N5O6 |
IUPAC Name |
(2s,3s)-3-[[(1r)-2-(4-guanidinobutylamino)-1-[(4-hydroxyphenyl)methyl]-2-oxo-ethyl]carbamoyl]oxirane-2-carboxylic acid |
Molecular Mass |
407.421 g·mol−1 |
Heat of Formation |
-824.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
8.47 ± 1.08 D |
Volume |
496.31 Å 3 |
Surface Area |
431.78 Å 2 |
HOMO Energy |
-9.22 ± 0.55 eV |
LUMO Energy |
-0.15 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
IVRMXEFFYRZNCU-RDBSUJKOSA-N |
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Elements |
H
C
O
N
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