Geometry & MOs

Info

ID:	278350
PubChem CID:	103834999
Reduced:	BrNS2O4C11H18 (1)
Stoich.:	ABC2D4E11F18 (1)
Weight, g/mol:	318.088557
ΔH_f, kcal/mol:	-146.3
Dipole, Da:	2.03
IP(EA), eV:	-9.48(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxy-4-methoxy-2-methylbutyl)-2-nitrobenzenesulfonamide

Drug info:

PubChemData

Smile

CC1=C(SC(=C1)S(=O)(=O)NCC(C)(CCOC)O)Br

DOS

IR

Vibrations