Geometry & MOs

Info

ID:	278586
PubChem CID:	103836607
Reduced:	FNSO3C13H20 (1)
Stoich.:	ABCD3E13F20 (1)
Weight, g/mol:	414.92754
ΔH_f, kcal/mol:	-180.74
Dipole, Da:	4.49
IP(EA), eV:	-10.02(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-dibromo-N-(4-hydroxy-2,2-dimethylbutyl)benzenesulfonamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)F)S(=O)(=O)NCC(C)(C)CCO

DOS

IR

Vibrations