Geometry & MOs

Info

ID:	30686
PubChem CID:	841725
Reduced:	BrNSO2C13H18 (1)
Stoich.:	ABCD2E13F18 (1)
Weight, g/mol:	261.059028
ΔH_f, kcal/mol:	-76.0
Dipole, Da:	4.28
IP(EA), eV:	-9.83(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-(2-methylbutan-2-yl)benzenesulfonamide

Drug info:

PubChemData

Smile

C[C@H]1CCCC[C@@H]1NS(=O)(=O)C2=CC=C(C=C2)Br

DOS

IR

Vibrations