Geometry & MOs

Info

ID:	62550
PubChem CID:	26719860
Reduced:	ClN3O3H18C20 (1)
Stoich.:	AB3C3D18E20 (1)
Weight, g/mol:	313.978046
ΔH_f, kcal/mol:	-44.74
Dipole, Da:	2.84
IP(EA), eV:	-9.0(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,6-dichloro-N-(3-chloro-4-methylphenyl)pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)C2=NN(C(=O)C=C2)CCOC3=CC=CC=C3)Cl

DOS

IR

Vibrations