Formula |
C30H31N7O |
IUPAC Name |
1-[3-[(6-amino-4-quinolyl)amino]phenyl]-3-[5-tert-butyl-2-(p-tolyl)-4h-pyrazol-2-ium-4-id-3-yl]urea |
Molecular Mass |
505.613 g·mol−1 |
Heat of Formation |
342.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
7.63 ± 1.08 D |
Volume |
615.65 Å 3 |
Surface Area |
533.02 Å 2 |
HOMO Energy |
-8.00 ± 0.55 eV |
LUMO Energy |
2.40 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
VOLXCNVOKHMTKN-UHFFFAOYSA-N |
QR Code |
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Elements |
H
C
O
N
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