Geometry & MOs

Info

ID:	143533
PubChem CID:	53223492
Reduced:	ClNO2H10C13 (1)
Stoich.:	ABC2D10E13 (1)
Weight, g/mol:	251.014934
ΔH_f, kcal/mol:	-43.62
Dipole, Da:	4.88
IP(EA), eV:	-9.76(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3-chloro-5-fluorophenyl)pyridine-3-carboxylic acid

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)Cl)C2=C(C=CC=N2)C(=O)O

DOS

IR

Vibrations