Geometry & MOs

Info

ID:

125881

PubChem CID:

50941917

Reduced:

N2C11H13 (1)

Stoich.:

A2B11C13 (1)

Weight, g/mol:

266.04186

ΔHf, kcal/mol:

58.84

Dipole, Da:

2.2

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.920636

Charge, e:

 0

Chem-info

IUPAC name:

1-phenyl-3-propylimidazol-3-ium;bromide

Drug info:

PubChemData

Smile

CC[N+]1=CN(C=C1)C2=CC=CC=C2

DOS

IR

Vibrations