Geometry & MOs

Info

ID:	142112
PubChem CID:	52984070
Reduced:	ON2C12H12 (1)
Stoich.:	AB2C12D12 (1)
Weight, g/mol:	243.089543
ΔH_f, kcal/mol:	-4.3
Dipole, Da:	6.66
IP(EA), eV:	-9.24(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-methoxy-3-methylphenyl)pyridine-3-carboxylic acid

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C2=CNC(=O)N=C2)C

DOS

IR

Vibrations