Geometry & MOs

Info

ID:	46332
PubChem CID:	10523918
Reduced:	NS2O3C19H27 (1)
Stoich.:	AB2C3D19E27 (1)
Weight, g/mol:	379.973355
ΔH_f, kcal/mol:	-73.48
Dipole, Da:	2.49
IP(EA), eV:	-8.48(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (3R)-2,5-dioxo-3-[2-(2,2,2-trichloroacetyl)pyrrol-1-yl]pyrrolidine-3-carboxylate

Drug info:

PubChemData

Smile

CCC(CCSC1=CC(=C(C(=C1)OC)OC)OC)(C2=CC=CS2)NC

DOS

IR

Vibrations