Geometry & MOs

Info

ID:	131951
PubChem CID:	51283979
Reduced:	ClFSN2O3C18H20 (1)
Stoich.:	ABCD2E3F18G20 (1)
Weight, g/mol:	380.096141
ΔH_f, kcal/mol:	-145.9
Dipole, Da:	8.63
IP(EA), eV:	-9.49(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N-[[4-(propan-2-ylsulfamoylmethyl)phenyl]methyl]benzamide

Drug info:

PubChemData

Smile

CC(C)NS(=O)(=O)CC1=CC=C(C=C1)CNC(=O)C2=C(C=CC=C2Cl)F

DOS

IR

Vibrations