Geometry & MOs

Info

ID:	87102
PubChem CID:	49892092
Reduced:	FSN2O4H21C25 (1)
Stoich.:	ABC2D4E21F25 (1)
Weight, g/mol:	440.076155
ΔH_f, kcal/mol:	-135.03
Dipole, Da:	10.45
IP(EA), eV:	-8.52(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[[1-(2-chlorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-3-[(2-fluorophenyl)methyl]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=CC(=C(N1C2=CC=CC=C2C(=O)OC)C)/C=C\3/C(=O)N(C(=O)S3)CC4=CC=CC=C4F

DOS

IR

Vibrations