Geometry & MOs

Info

ID:	178481
PubChem CID:	76335855
Reduced:	N5C17H21 (1)
Stoich.:	A5B17C21 (1)
Weight, g/mol:	348.102941
ΔH_f, kcal/mol:	83.0
Dipole, Da:	7.58
IP(EA), eV:	-9.14(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-chloroindol-1-yl)-1-(2-methylprop-2-enyl)quinolin-4-one

Drug info:

PubChemData

Smile

CC1CC(CN(C1)C2=NN3C(=NN=C3C4=CC=CC=C42)C)C

DOS

IR

Vibrations