Geometry & MOs

Info

ID:	426620
PubChem CID:	135152512
Reduced:	NC5H5 (4)
Stoich.:	AB5C5 (4)
Weight, g/mol:	300.162649
ΔH_f, kcal/mol:	103.03
Dipole, Da:	1.11
IP(EA), eV:	-9.62(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3,5-trimethyl-1-quinolin-6-yl-4H-isoquinoline

Drug info:

PubChemData

Smile

CC1(C2=C(C=CN=C2)C(=NC1(C)C)C3=NC4=CC=CC=C4N=C3)C

DOS

IR

Vibrations