Geometry & MOs

Info

ID:	28582
PubChem CID:	828453
Reduced:	ClON3H14C18 (1)
Stoich.:	ABC3D14E18 (1)
Weight, g/mol:	274.110613
ΔH_f, kcal/mol:	52.14
Dipole, Da:	1.66
IP(EA), eV:	-8.46(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6,8-dimethyl-2-phenoxyquinoline-3-carbonitrile

Drug info:

PubChemData

Smile

CC1=C2C(=CC=C1)C=C(C(=N2)NC3=C(C=CC(=C3)Cl)OC)C#N

DOS

IR

Vibrations