Geometry & MOs

Info

ID:

11793

PubChem CID:

121055

Reduced:

NH3C4 (3)

Stoich.:

AB3C4 (3)

Weight, g/mol:

195.079647

ΔHf, kcal/mol:

90.63

Dipole, Da:

0.21

IP(EA), eV:

-10.56(-1.41)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2,4,6-trimethylbenzene-1,3,5-tricarbonitrile

Drug info:

PubChemData

Smile

CC1=C(C(=C(C(=C1C#N)C)C#N)C)C#N

DOS

IR

Vibrations