Geometry & MOs

Info

ID:	212492
PubChem CID:	81060716
Reduced:	N3C11H15 (1)
Stoich.:	A3B11C15 (1)
Weight, g/mol:	280.157563
ΔH_f, kcal/mol:	38.4
Dipole, Da:	5.52
IP(EA), eV:	-8.71(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-tert-butylphenoxy)-2,6-dimethylpyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CCN(C)C1=C(C(=NC(=C1)C)C)C#N

DOS

IR

Vibrations