Geometry & MOs

Info

ID:	278406
PubChem CID:	103835384
Reduced:	NS2O5C12H19 (1)
Stoich.:	AB2C5D12E19 (1)
Weight, g/mol:	271.124215
ΔH_f, kcal/mol:	-199.24
Dipole, Da:	7.27
IP(EA), eV:	-9.72(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxy-2-methylpentyl)-3-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

CCCC(C)(CNS(=O)(=O)C1=C(SC=C1)C(=O)OC)O

DOS

IR

Vibrations