Geometry & MOs

Info

ID:	130686
PubChem CID:	51092028
Reduced:	SO2N3C17H17 (1)
Stoich.:	AB2C3D17E17 (1)
Weight, g/mol:	347.103669
ΔH_f, kcal/mol:	18.96
Dipole, Da:	3.49
IP(EA), eV:	-9.43(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-6-ethoxy-N-[4-(propanoylamino)phenyl]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CCC1=NC(=CS1)CC(=O)NCC2=CC(=NO2)C3=CC=CC=C3

DOS

IR

Vibrations