Geometry & MOs

Info

ID:	143537
PubChem CID:	53223994
Reduced:	NCl2O3H7C12 (1)
Stoich.:	AB2C3D7E12 (1)
Weight, g/mol:	282.980299
ΔH_f, kcal/mol:	-95.9
Dipole, Da:	5.29
IP(EA), eV:	-9.82(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2,4-dichlorophenyl)-6-oxo-1H-pyridine-3-carboxylic acid

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Cl)Cl)C2=CNC(=O)C=C2C(=O)O

DOS

IR

Vibrations