Formula |
C16H22N6O4 |
IUPAC Name |
(2s)-n-[(1r)-2-[(2r)-2-carbamoylpyrrolidin-1-yl]-2-oxo-1-(pyrazol-2-ium-1-id-3-ylmethyl)ethyl]-5-oxo-pyrrolidine-2-carboxamide |
Molecular Mass |
362.384 g·mol−1 |
Heat of Formation |
-590.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.77 ± 1.08 D |
Volume |
423.61 Å 3 |
Surface Area |
345.5 Å 2 |
HOMO Energy |
-9.80 ± 0.55 eV |
LUMO Energy |
3.15 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
YMUAIJKCQCFCKS-QJPTWQEYSA-N |
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Links |
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Elements |
H
C
O
N
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