Formula |
C17H21N7O4 |
IUPAC Name |
(z)-2-diazonio-1-[(2s)-1-[(2s)-3-(1h-imidazol-5-yl)-2-[[(2s)-5-oxopyrrolidine-2-carbonyl]amino]propanoyl]pyrrolidin-2-yl]ethenolate |
Molecular Mass |
387.393 g·mol−1 |
Heat of Formation |
-343.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.37 ± 1.08 D |
Volume |
453.61 Å 3 |
Surface Area |
389.62 Å 2 |
HOMO Energy |
-9.60 ± 0.55 eV |
LUMO Energy |
-0.59 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
IQCABGUDODPCBZ-NPZYLRNOSA-N |
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Elements |
H
C
O
N
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