Geometry & MOs

Info

ID:	62509
PubChem CID:	26719818
Reduced:	NOSC11H13 (2)
Stoich.:	ABCD11E13 (2)
Weight, g/mol:	311.989089
ΔH_f, kcal/mol:	-54.4
Dipole, Da:	3.3
IP(EA), eV:	-8.6(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CSC1=CC=CC(=C1)NC(=O)C2CCC(CC2)C(=O)NC3=CC(=CC=C3)SC

DOS

IR

Vibrations