Geometry & MOs

Info

ID:	158480
PubChem CID:	56463797
Reduced:	SN2O6C21H22 (1)
Stoich.:	AB2C6D21E22 (1)
Weight, g/mol:	421.155909
ΔH_f, kcal/mol:	-196.72
Dipole, Da:	7.27
IP(EA), eV:	-9.42(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethoxy-N-(2-ethylsulfonylethyl)-4-(2-phenoxyethoxy)benzamide

Drug info:

PubChemData

Smile

CCS(=O)(=O)CCNC(=O)C1=C(C=CC(=C1)CN2C(=O)C3=CC=CC=C3C2=O)OC

DOS

IR

Vibrations