Geometry & MOs

Info

ID:	25746
PubChem CID:	630109
Reduced:	NS2F3O4C10H10 (1)
Stoich.:	AB2C3D4E10F10 (1)
Weight, g/mol:	418.01782
ΔH_f, kcal/mol:	-308.73
Dipole, Da:	2.86
IP(EA), eV:	-8.85(-1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-iodophenyl)-3-(2-phenylethylideneamino)pyrrolidine-2,5-dione

Drug info:

PubChemData

Smile

COC(=O)CSC1=C(C(=C(S1)C(=O)OC)N)C(F)(F)F

DOS

IR

Vibrations