Geometry & MOs

Info

ID:	60409
PubChem CID:	26684479
Reduced:	SF2N2O2C12H12 (1)
Stoich.:	AB2C2D2E12F12 (1)
Weight, g/mol:	264.093249
ΔH_f, kcal/mol:	-153.99
Dipole, Da:	5.89
IP(EA), eV:	-9.16(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5S)-5-methyl-3-[2-(3-methylphenoxy)ethyl]-2-sulfanylideneimidazolidin-4-one

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations