Geometry & MOs

Info

ID:

206660

PubChem CID:

80278923

Reduced:

H2N2C3 (2)

Stoich.:

A2B2C3 (2)

Weight, g/mol:

251.08071

ΔHf, kcal/mol:

108.33

Dipole, Da:

5.73

IP(EA), eV:

-10.25(-0.88)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-(2-cyanoimidazol-1-yl)-N-(2-cyanophenyl)acetamide

Drug info:

PubChemData

Smile

C1=CN(C(=N1)C#N)CC#N

DOS

IR

Vibrations