Formula |
C21H22N4O4 |
IUPAC Name |
(z,3s)-3-[[(2s)-2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]amino]-1-diazonio-but-1-en-2-olate |
Molecular Mass |
394.424 g·mol−1 |
Heat of Formation |
-319.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.39 ± 1.08 D |
Volume |
481.67 Å 3 |
Surface Area |
406.85 Å 2 |
HOMO Energy |
-9.57 ± 0.55 eV |
LUMO Energy |
2.27 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
MWTMWVGTMFXOSZ-BBMJWPBGSA-N |
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Elements |
H
C
O
N
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