Geometry & MOs

Info

ID:	36767
PubChem CID:	8012418
Reduced:	SN3O3C19H27 (1)
Stoich.:	AB3C3D19E27 (1)
Weight, g/mol:	328.028456
ΔH_f, kcal/mol:	-122.2
Dipole, Da:	2.12
IP(EA), eV:	-8.94(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-chloro-5-methylsulfanylbenzoate

Drug info:

PubChemData

Smile

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1SCC(=O)N[C@H](C)C(C)C

DOS

IR

Vibrations