Geometry & MOs

Info

ID:	130681
PubChem CID:	51092004
Reduced:	SN2O3C18H22 (1)
Stoich.:	AB2C3D18E22 (1)
Weight, g/mol:	347.103669
ΔH_f, kcal/mol:	-86.2
Dipole, Da:	1.96
IP(EA), eV:	-9.23(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN(C)C(=O)C1CCCN(C1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2

DOS

IR

Vibrations