Geometry & MOs

Info

ID:	124144
PubChem CID:	50873520
Reduced:	NO2S2H15C21 (1)
Stoich.:	AB2C2D15E21 (1)
Weight, g/mol:	299.93682
ΔH_f, kcal/mol:	47.75
Dipole, Da:	2.85
IP(EA), eV:	-8.8(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5E)-5-[(5-bromo-2-fluorophenyl)methylidene]-2-sulfanylideneimidazolidin-4-one

Drug info:

PubChemData

Smile

C/C(=C\C1=CC=CO1)/C=C/2\C(=O)N(C(=S)S2)C3=CC=CC4=CC=CC=C43

DOS

IR

Vibrations