Geometry & MOs

Info

ID:	268957
PubChem CID:	103603065
Reduced:	BrNSO2C15H16 (1)
Stoich.:	ABCD2E15F16 (1)
Weight, g/mol:	279.072928
ΔH_f, kcal/mol:	-33.3
Dipole, Da:	4.17
IP(EA), eV:	-8.54(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(benzenesulfonyl)ethyl]-4-fluoroaniline

Drug info:

PubChemData

Smile

CC1=CC=CC=C1NCCS(=O)(=O)C2=CC=C(C=C2)Br

DOS

IR

Vibrations