Formula |
C15H19N5O5 |
IUPAC Name |
(2s)-2-[hydroxy(methyl)amino]-n-[4-[(3-methyl-2-nitro-imidazol-1-ium-4-id-4-yl)methoxy]phenyl]propanamide |
Molecular Mass |
349.342 g·mol−1 |
Heat of Formation |
-168.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.17 ± 1.08 D |
Volume |
406.51 Å 3 |
Surface Area |
354.51 Å 2 |
HOMO Energy |
-9.48 ± 0.55 eV |
LUMO Energy |
-1.19 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
OXRATBZYZYGARK-JTQLQIEISA-N |
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Elements |
H
C
O
N
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