Geometry & MOs

Info

ID:	212451
PubChem CID:	81060577
Reduced:	ION2H11C14 (1)
Stoich.:	ABC2D11E14 (1)
Weight, g/mol:	219.137162
ΔH_f, kcal/mol:	52.42
Dipole, Da:	4.64
IP(EA), eV:	-9.59(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(dimethylamino)ethoxy]-2,6-dimethylpyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)C#N)OC2=CC=C(C=C2)I

DOS

IR

Vibrations