Geometry & MOs

Info

ID:	60397
PubChem CID:	26684150
Reduced:	SN2O2C13H16 (1)
Stoich.:	AB2C2D13E16 (1)
Weight, g/mol:	260.023119
ΔH_f, kcal/mol:	-53.22
Dipole, Da:	4.08
IP(EA), eV:	-8.71(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5R)-5-methyl-2-sulfanylidene-3-(2,3,4-trifluorophenyl)imidazolidin-4-one

Drug info:

PubChemData

Smile

C[C@@H]1C(=O)N(C(=S)N1)CCC2=CC=C(C=C2)OC

DOS

IR

Vibrations