Geometry & MOs

Info

ID:	278553
PubChem CID:	103836484
Reduced:	NSO3C15H25 (1)
Stoich.:	ABC3D15E25 (1)
Weight, g/mol:	380.00416
ΔH_f, kcal/mol:	-139.21
Dipole, Da:	6.43
IP(EA), eV:	-9.86(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-(4-hydroxy-2,2-dimethylbutyl)-2-nitrobenzenesulfonamide

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)S(=O)(=O)NCC(C)(C)CCO

DOS

IR

Vibrations