Geometry & MOs

Info

ID:	212209
PubChem CID:	81059825
Reduced:	N3C17H27 (1)
Stoich.:	A3B17C27 (1)
Weight, g/mol:	226.121846
ΔH_f, kcal/mol:	5.87
Dipole, Da:	5.29
IP(EA), eV:	-8.76(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-ethylimidazol-1-yl)-2,6-dimethylpyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CCC(CC)N(CC(C)C)C1=C(C(=NC(=C1)C)C)C#N

DOS

IR

Vibrations