Geometry & MOs

Info

ID:	86893
PubChem CID:	49889909
Reduced:	FNS2O6H16C19 (1)
Stoich.:	ABC2D6E16F19 (1)
Weight, g/mol:	484.02564
ΔH_f, kcal/mol:	-224.74
Dipole, Da:	6.54
IP(EA), eV:	-8.99(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)/C=C\2/C(=O)N(C(=O)S2)CC3=CC=C(C=C3)F)OS(=O)(=O)C

DOS

IR

Vibrations