Geometry & MOs

Info

ID:

125880

PubChem CID:

50941916

Reduced:

BrN2C11H13 (1)

Stoich.:

AB2C11D13 (1)

Weight, g/mol:

173.107873

ΔHf, kcal/mol:

29.35

Dipole, Da:

3.75

IP(EA), eV:

-7.88(-0.34)

Spin(Sz, S2):

None, None

Charge, e:

1

Chem-info

IUPAC name:

1-ethyl-3-phenylimidazol-1-ium

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations