Geometry & MOs

Info

ID:	11456
PubChem CID:	115867
Reduced:	N2C15H16 (2)
Stoich.:	A2B15C16 (2)
Weight, g/mol:	448.262697
ΔH_f, kcal/mol:	135.68
Dipole, Da:	16.37
IP(EA), eV:	-5.22(-1.88)
Spin(S_z, S²):	None, None
Charge, e:	2

Chem-info

IUPAC name:

1-methyl-2-[6-(1-methyl-9H-pyrido[3,4-b]indol-2-ium-2-yl)hexyl]-9H-pyrido[3,4-b]indol-2-ium

Drug info:

PubChemData

Smile

CC1=[N+](C=CC2=C1NC3=CC=CC=C23)CCCCCC[N+]4=C(C5=C(C=C4)C6=CC=CC=C6N5)C

DOS

IR

Vibrations