Geometry & MOs

Info

ID:	158369
PubChem CID:	56463520
Reduced:	ClFN2S2O4C17H18 (1)
Stoich.:	ABC2D2E4F17G18 (1)
Weight, g/mol:	428.036434
ΔH_f, kcal/mol:	-190.68
Dipole, Da:	5.49
IP(EA), eV:	-9.28(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-dichloro-N-[4-(2-ethylsulfonylethylcarbamoyl)phenyl]benzamide

Drug info:

PubChemData

Smile

CCS(=O)(=O)CCNC(=O)C1=C(C=C(S1)NC(=O)C2=C(C=C(C=C2)F)Cl)C

DOS

IR

Vibrations