Formula |
C17H21F3N6O4 |
IUPAC Name |
(2s)-n-[(2s)-1-[(2r)-2-amino-3-[2-(trifluoromethyl)imidazol-3-ium-4-ylium-4-yl]propanoyl]pyrrolidine-2-carbonyl]-5-oxo-pyrrolidine-2-carboxamide |
Molecular Mass |
430.382 g·mol−1 |
Heat of Formation |
-1260.9 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.79 ± 1.08 D |
Volume |
475.1 Å 3 |
Surface Area |
384.14 Å 2 |
HOMO Energy |
-9.75 ± 0.55 eV |
LUMO Energy |
2.46 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
VFWHEXLJERBSPY-VWYCJHECSA-N |
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Links |
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Downloads |
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Elements |
H
C
N
O
F
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