Geometry & MOs

Info

ID:	278573
PubChem CID:	103836569
Reduced:	SN2O5C12H18 (1)
Stoich.:	AB2C5D12E18 (1)
Weight, g/mol:	299.155515
ΔH_f, kcal/mol:	-116.68
Dipole, Da:	6.63
IP(EA), eV:	-10.27(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-hydroxy-2,2-dimethylbutyl)-2,4,6-trimethylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC(C)(CCO)CNS(=O)(=O)C1=CC=CC=C1[N+](=O)[O-]

DOS

IR

Vibrations