Geometry & MOs

Info

ID:	278164
PubChem CID:	103833821
Reduced:	NSF3O3C13H18 (1)
Stoich.:	ABC3D3E13F18 (1)
Weight, g/mol:	428.94319
ΔH_f, kcal/mol:	-268.51
Dipole, Da:	4.01
IP(EA), eV:	-9.99(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-dibromo-N-(1-hydroxy-4,4-dimethylpentan-3-yl)benzenesulfonamide

Drug info:

PubChemData

Smile

CC(C)(C)C(CCO)NS(=O)(=O)C1=C(C=C(C=C1F)F)F

DOS

IR

Vibrations