Geometry & MOs

Info

ID:	87298
PubChem CID:	49893836
Reduced:	SI2N2O4H18C25 (1)
Stoich.:	AB2C2D4E18F25 (1)
Weight, g/mol:	586.95884
ΔH_f, kcal/mol:	-29.56
Dipole, Da:	1.9
IP(EA), eV:	-9.12(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[[3,5-dibromo-4-[(4-methylphenyl)methoxy]phenyl]methylidene]-3-[(4-methylphenyl)methyl]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COC2=C(C=C(C=C2I)I)/C=C\3/C(=O)N(C(=O)S3)CC(=O)NC4=CC=CC=C4

DOS

IR

Vibrations