Geometry & MOs

Info

ID:	60402
PubChem CID:	26684380
Reduced:	SN2O2C13H16 (1)
Stoich.:	AB2C2D13E16 (1)
Weight, g/mol:	284.098334
ΔH_f, kcal/mol:	-53.09
Dipole, Da:	2.38
IP(EA), eV:	-8.85(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5R)-5-methyl-3-[(1R)-1-naphthalen-2-ylethyl]-2-sulfanylideneimidazolidin-4-one

Drug info:

PubChemData

Smile

C[C@@H]1C(=O)N(C(=S)N1)[C@H](C)C2=CC=CC=C2OC

DOS

IR

Vibrations