Geometry & MOs

Info

ID:	88146
PubChem CID:	49901860
Reduced:	BrSN2O4H23C27 (1)
Stoich.:	ABC2D4E23F27 (1)
Weight, g/mol:	470.87625
ΔH_f, kcal/mol:	-85.85
Dipole, Da:	3.1
IP(EA), eV:	-8.76(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)COC2=CC=C(C=C2)/C=C\3/C(=O)N(C(=O)S3)CC4=CC=C(C=C4)Br)C

DOS

IR

Vibrations