Geometry & MOs

Info

ID:	407065
PubChem CID:	135079229
Reduced:	NSO3C21H23 (1)
Stoich.:	ABC3D21E23 (1)
Weight, g/mol:	227.078013
ΔH_f, kcal/mol:	-32.4
Dipole, Da:	8.2
IP(EA), eV:	-8.55(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(NE,R)-N-[(4-fluorophenyl)methylidene]-2-methylpropane-2-sulfinamide

Drug info:

PubChemData

Smile

CC#CCN(C/C=C/C1=CC=C(C=C1)OC)S(=O)(=O)C2=CC=C(C=C2)C

DOS

IR

Vibrations