Geometry & MOs

Info

ID:	30996
PubChem CID:	854060
Reduced:	OSN2C12H12 (1)
Stoich.:	ABC2D12E12 (1)
Weight, g/mol:	234.082684
ΔH_f, kcal/mol:	3.98
Dipole, Da:	3.34
IP(EA), eV:	-8.96(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5S)-3-phenyl-5-propan-2-yl-2-sulfanylideneimidazolidin-4-one

Drug info:

PubChemData

Smile

C1C[C@@H]2C(=O)N(C(=S)N2C1)C3=CC=CC=C3

DOS

IR

Vibrations