Formula |
C18H23N5O2 |
IUPAC Name |
2-cyclopropyl-n-[(1r)-1-methyl-2-oxo-2-(1-piperidyl)ethyl]pyrrolo[2,3-b]pyrazin-5-ium-4a-ylium-7-carboxamide |
Molecular Mass |
341.408 g·mol−1 |
Heat of Formation |
-63.9 ± 16.7 kJ·mol−1 |
Dipole Moment |
1.63 ± 1.08 D |
Volume |
415.04 Å 3 |
Surface Area |
368.41 Å 2 |
HOMO Energy |
-9.32 ± 0.55 eV |
LUMO Energy |
-0.86 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
STEKXUJMQOKLQV-LLVKDONJSA-N |
QR Code |
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Links |
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Downloads |
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Elements |
H
C
O
N
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