Geometry & MOs

Info

ID:	413076
PubChem CID:	135086020
Reduced:	FNSO2H12C15 (1)
Stoich.:	ABCD2E12F15 (1)
Weight, g/mol:	305.027728
ΔH_f, kcal/mol:	-24.51
Dipole, Da:	5.82
IP(EA), eV:	-8.6(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-chlorophenyl)ethynyl]-N-phenylmethanesulfonamide

Drug info:

PubChemData

Smile

CS(=O)(=O)N(C#CC1=CC=C(C=C1)F)C2=CC=CC=C2

DOS

IR

Vibrations