Geometry & MOs

Info

ID:	212632
PubChem CID:	81061269
Reduced:	ON2C12H16 (1)
Stoich.:	AB2C12D16 (1)
Weight, g/mol:	270.082684
ΔH_f, kcal/mol:	-20.24
Dipole, Da:	3.07
IP(EA), eV:	-9.76(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)C#N)OC(C)(C)C

DOS

IR

Vibrations