Formula |
C23H28N8O2 |
IUPAC Name |
8-[2-methoxy-5-(4-methylpiperazin-1-yl)anilino]-1-methyl-4,5-dihydropyrazolo[4,3-h]quinazolin-1-ium-9b-ylium-3-carboxamide |
Molecular Mass |
448.521 g·mol−1 |
Heat of Formation |
146.8 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.81 ± 1.08 D |
Volume |
522.36 Å 3 |
Surface Area |
454.6 Å 2 |
HOMO Energy |
-8.18 ± 0.55 eV |
LUMO Energy |
2.20 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
SWTRIZHCIUWGAU-UHFFFAOYSA-N |
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Elements |
H
C
O
N
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