Geometry & MOs

Info

ID:	373866
PubChem CID:	131320781
Reduced:	N2O2H8C9 (1)
Stoich.:	A2B2C8D9 (1)
Weight, g/mol:	176.058578
ΔH_f, kcal/mol:	-18.37
Dipole, Da:	5.08
IP(EA), eV:	-8.6(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-cyano-4,6-dimethylpyridine-3-carboxylic acid

Drug info:

PubChemData

Smile

CC1=C(C(=CC2=C1OCO2)C#N)N

DOS

IR

Vibrations