Geometry & MOs

Info

ID:	68953
PubChem CID:	46513484
Reduced:	BrO2N3H18C19 (1)
Stoich.:	AB2C3D18E19 (1)
Weight, g/mol:	444.067734
ΔH_f, kcal/mol:	1.5
Dipole, Da:	4.92
IP(EA), eV:	-8.98(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[1-(4-chlorophenyl)-2-methylpropyl]-3-[methoxy(methyl)sulfamoyl]benzamide

Drug info:

PubChemData

Smile

CN1C=CN=C1C(C2=CC=C(C=C2)OC)NC(=O)C3=CC=C(C=C3)Br

DOS

IR

Vibrations