(6S,8E)-2-Chloro-10-Hydroxy-8-(4-Methylpiperazin-1-Yl)Imino-6-[4-(Trifluoromethyl)Cyclohexyl]-1,3,4,5,6,7-Hexahydroacridine-1,2,3,4,4A,8A,9A,10A-Octaid-9-One
Properties
Property | Value |
---|---|
Formula | C25H39ClF3N4O2+ |
IUPAC Name | (6s,8e)-2-chloro-10-hydroxy-8-(4-methylpiperazin-1-yl)imino-6-[4-(trifluoromethyl)cyclohexyl]-1,3,4,5,6,7-hexahydroacridine-1,2,3,4,4a,8a,9a,10a-octaid-9-one |
Molecular Mass | 520.051 g·mol−1 |
Heat of Formation | -493.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.60 ± 1.08 D |
Volume | 554.53 Å 3 |
Surface Area | 472.69 Å 2 |
HOMO Energy | -8.56 ± 0.55 eV |
LUMO Energy | 1.96 ± eV |
Point Group Symmetry | C1 |
InChIKey | UWHMMCUTNGWYJM-XDLTXGNGSA-O |
QR Code | Generate QR Code |
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Elements | C F H Cl O N |