Geometry & MOs

Info

ID:	124250
PubChem CID:	50876243
Reduced:	BrSN2O3C19H21 (1)
Stoich.:	ABC2D3E19F21 (1)
Weight, g/mol:	301.090328
ΔH_f, kcal/mol:	-58.41
Dipole, Da:	4.28
IP(EA), eV:	-9.38(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-3-methyl-N-(2-methylcyclohexyl)benzenesulfonamide

Drug info:

PubChemData

Smile

CCCOC1=C(C=CC(=C1)S(=O)(=O)N2CCN=C2CC3=CC=CC=C3)Br

DOS

IR

Vibrations