Geometry & MOs

Info

ID:	88216
PubChem CID:	49902320
Reduced:	SN2Cl3O4H17C25 (1)
Stoich.:	AB2C3D4E17F25 (1)
Weight, g/mol:	602.95376
ΔH_f, kcal/mol:	-93.2
Dipole, Da:	6.22
IP(EA), eV:	-9.23(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)Cl)CN2C(=O)/C(=C/C3=C(C=CC(=C3)Cl)OCC(=O)NC4=CC=C(C=C4)Cl)/SC2=O

DOS

IR

Vibrations