Geometry & MOs

Info

ID:

212392

PubChem CID:

81060358

Reduced:

N3O3H13C15 (1)

Stoich.:

A3B3C13D15 (1)

Weight, g/mol:

266.141913

ΔHf, kcal/mol:

27.12

Dipole, Da:

9.0

IP(EA), eV:

-10.08(-1.57)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2,6-dimethyl-4-(4-propan-2-ylphenoxy)pyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OC2=C(C(=NC(=C2)C)C)C#N)[N+](=O)[O-]

DOS

IR

Vibrations