Geometry & MOs

Info

ID:	308605
PubChem CID:	126497138
Reduced:	NC8H8 (4)
Stoich.:	AB8C8 (4)
Weight, g/mol:	498.253195
ΔH_f, kcal/mol:	124.4
Dipole, Da:	4.13
IP(EA), eV:	-8.39(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-(2-ethenylphenyl)-1-phenyl-2H-imidazo[4,5-b]pyrazin-2-yl]-3,5-dimethyl-4,5-dihydro-3aH-imidazo[1,2-a]quinoline

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C)C2=C3C(=NC=N2)N4C(N3C5=CC=CC=C5)C(C(C6=CC=CC=C64)(C)C=C)(C)C

DOS

IR

Vibrations