Geometry & MOs

Info

ID:	60411
PubChem CID:	26684830
Reduced:	FN2O2S2C19H19 (1)
Stoich.:	AB2C2D2E19F19 (1)
Weight, g/mol:	330.083827
ΔH_f, kcal/mol:	-62.75
Dipole, Da:	5.59
IP(EA), eV:	-8.96(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5S)-3-[[4-(4-fluorophenoxy)phenyl]methyl]-5-methyl-2-sulfanylideneimidazolidin-4-one

Drug info:

PubChemData

Smile

CSCC[C@@H]1C(=O)N(C(=S)N1)CC2=CC=C(C=C2)OC3=CC=C(C=C3)F

DOS

IR

Vibrations