Geometry & MOs

Info

ID:	172823
PubChem CID:	75556952
Reduced:	ION3H12C13 (1)
Stoich.:	ABC3D12E13 (1)
Weight, g/mol:	350.029205
ΔH_f, kcal/mol:	65.7
Dipole, Da:	5.97
IP(EA), eV:	-8.46(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2-chloro-6-fluorophenyl)methyl]-5-[(1-methylpyrrol-3-yl)methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CN1C=CC(=C1)C=NNC(=O)C2=CC(=CC=C2)I

DOS

IR

Vibrations