Geometry & MOs

Info

ID:	411301
PubChem CID:	135084114
Reduced:	ClSN2O2H11C12 (1)
Stoich.:	ABC2D2E11F12 (1)
Weight, g/mol:	221.121592
ΔH_f, kcal/mol:	-23.86
Dipole, Da:	5.68
IP(EA), eV:	-8.77(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-fluoro-2-(2-methylprop-2-enyl)phenyl]propanamide

Drug info:

PubChemData

Smile

CN(C1=CC=C(C=C1)Cl)S(=O)(=O)C2=CC=CC=N2

DOS

IR

Vibrations