Geometry & MOs

Info

ID:	4052
PubChem CID:	10649
Reduced:	ClN2C15H20 (2)
Stoich.:	AB2C15D20 (2)
Weight, g/mol:	526.263003
ΔH_f, kcal/mol:	-7.69
Dipole, Da:	13.71
IP(EA), eV:	-7.54(-1.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[10-(4-amino-2-methylquinolin-1-ium-1-yl)decyl]-2-methylquinolin-1-ium-4-amine;dichloride

Drug info:

PubChemData

Smile

CC1=[N+](C2=CC=CC=C2C(=C1)N)CCCCCCCCCC[N+]3=C(C=C(C4=CC=CC=C43)N)C.[Cl-].[Cl-]

DOS

IR

Vibrations