Geometry & MOs

Info

ID:	143539
PubChem CID:	53223996
Reduced:	NCl2O3H9C13 (1)
Stoich.:	AB2C3D9E13 (1)
Weight, g/mol:	300.946412
ΔH_f, kcal/mol:	-88.87
Dipole, Da:	4.98
IP(EA), eV:	-9.65(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-5-(2,4-dichlorophenyl)pyridine-3-carboxylic acid

Drug info:

PubChemData

Smile

COC1=C(C=C(C=N1)C2=C(C=C(C=C2)Cl)Cl)C(=O)O

DOS

IR

Vibrations