Geometry & MOs

Info

ID:	156447
PubChem CID:	56370669
Reduced:	BrNSO4C20H24 (1)
Stoich.:	ABCD4E20F24 (1)
Weight, g/mol:	409.005468
ΔH_f, kcal/mol:	-132.77
Dipole, Da:	2.39
IP(EA), eV:	-9.43(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-(3-chloro-4-imidazol-1-ylphenyl)-3-methylsulfonylbenzamide

Drug info:

PubChemData

Smile

CCOCC1=CC=C(C=C1)CNC(=O)C(C)(C)S(=O)(=O)C2=CC=C(C=C2)Br

DOS

IR

Vibrations