Geometry & MOs

Info

ID:

212379

PubChem CID:

81060308

Reduced:

ON2C16H16 (1)

Stoich.:

AB2C16D16 (1)

Weight, g/mol:

238.110613

ΔHf, kcal/mol:

16.1

Dipole, Da:

6.05

IP(EA), eV:

-9.49(-0.62)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2,6-dimethyl-4-(2-methylphenoxy)pyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OC2=C(C(=NC(=C2)C)C)C#N)C

DOS

IR

Vibrations