Geometry & MOs

Info

ID:	383306
PubChem CID:	134974949
Reduced:	N11C15H21 (1)
Stoich.:	A11B15C21 (1)
Weight, g/mol:	442.191937
ΔH_f, kcal/mol:	346.12
Dipole, Da:	11.48
IP(EA), eV:	-8.86(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

N-[1-[2-(3-methylbenzimidazol-3-ium-1-yl)naphthalen-1-yl]naphthalen-2-yl]acetamide

Drug info:

PubChemData

Smile

C1CN2C=C(CN3CC4=CN(CCN1CCN5C=C(C3)N=N5)N=N4)N=N2

DOS

IR

Vibrations