Geometry & MOs

Info

ID:	11181
PubChem CID:	111592
Reduced:	ClNH16C17 (1)
Stoich.:	ABC16D17 (1)
Weight, g/mol:	269.097127
ΔH_f, kcal/mol:	55.18
Dipole, Da:	7.16
IP(EA), eV:	-8.7(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzyl-2-methylquinolin-1-ium;chloride

Drug info:

PubChemData

Smile

CC1=[N+](C2=CC=CC=C2C=C1)CC3=CC=CC=C3.[Cl-]

DOS

IR

Vibrations