Geometry & MOs

Info

ID:	272951
PubChem CID:	103768608
Reduced:	BrNS2O3C12H18 (1)
Stoich.:	ABC2D3E12F18 (1)
Weight, g/mol:	365.00966
ΔH_f, kcal/mol:	-106.73
Dipole, Da:	4.78
IP(EA), eV:	-9.43(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-3-fluoro-N-[1-(oxan-4-yl)ethyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CC1=C(SC(=C1)S(=O)(=O)NC(C)C2CCOCC2)Br

DOS

IR

Vibrations