Geometry & MOs

Info

ID:	73452
PubChem CID:	48417748
Reduced:	SO4N5C19H21 (1)
Stoich.:	AB4C5D19E21 (1)
Weight, g/mol:	363.125277
ΔH_f, kcal/mol:	-84.74
Dipole, Da:	7.73
IP(EA), eV:	-8.75(-1.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methoxy-N-[2-methyl-3-(propylsulfonylamino)phenyl]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CCCS(=O)(=O)NC1=CC=CC(=C1C)NC(=O)CN2C(=O)C3=CC=CC=C3N=N2

DOS

IR

Vibrations