Geometry & MOs

Info

ID:	308660
PubChem CID:	126497290
Reduced:	N5C23H23 (1)
Stoich.:	A5B23C23 (1)
Weight, g/mol:	526.284495
ΔH_f, kcal/mol:	124.78
Dipole, Da:	6.05
IP(EA), eV:	-8.38(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[7-(2-ethenylphenyl)-9-methyl-2-(2-methylphenyl)-8H-purin-8-yl]-3,5-dimethyl-4,5-dihydro-3aH-imidazo[1,2-a]quinoline

Drug info:

PubChemData

Smile

CC1(C2N(C3=NC=NC=C3N2C4=CC=CC=C4C1(C)C=C)C5=CN=CC=C5)C

DOS

IR

Vibrations