Formula |
C22H23ClN6 |
IUPAC Name |
n-(2-chloro-6-methyl-phenyl)-8-[(1s,3s)-3-methylpiperazin-1-yl]-3h-imidazo[1,5-a]quinoxalin-10-ium-3-ylium-4-amine |
Molecular Mass |
406.911 g·mol−1 |
Heat of Formation |
415.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.92 ± 1.08 D |
Volume |
474.56 Å 3 |
Surface Area |
405.83 Å 2 |
HOMO Energy |
-8.11 ± 0.55 eV |
LUMO Energy |
2.29 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
VWJPPYCULHDHBB-HNNXBMFYSA-N |
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Links |
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Elements |
H
C
N
Cl
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