Geometry & MOs

Info

ID:	176150
PubChem CID:	76001950
Reduced:	FN2O2H13C14 (1)
Stoich.:	AB2C2D13E14 (1)
Weight, g/mol:	243.089543
ΔH_f, kcal/mol:	-69.02
Dipole, Da:	3.24
IP(EA), eV:	-9.89(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3,5-dimethylphenyl)-2-oxo-3H-pyridine-3-carboxylic acid

Drug info:

PubChemData

Smile

CCNC(=O)C1=C(C=C(C=C1)C2C=CC=NC2=O)F

DOS

IR

Vibrations