Geometry & MOs

Info

ID:	398458
PubChem CID:	135033358
Reduced:	ClNOH14C22 (1)
Stoich.:	ABCD14E22 (1)
Weight, g/mol:	359.071306
ΔH_f, kcal/mol:	61.61
Dipole, Da:	1.3
IP(EA), eV:	-9.41(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-chlorophenyl)-(1-oxido-4-phenylquinolin-1-ium-3-yl)methanone

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=C(C=NC3=CC=CC=C32)C(=O)C4=CC=CC=C4Cl

DOS

IR

Vibrations