Geometry & MOs

Info

ID:	86692
PubChem CID:	49888522
Reduced:	SCl2N2O2H18C23 (1)
Stoich.:	AB2C2D2E18F23 (1)
Weight, g/mol:	576.9517
ΔH_f, kcal/mol:	-22.92
Dipole, Da:	5.12
IP(EA), eV:	-8.81(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[[3-bromo-4-[(2-chlorophenyl)methoxy]-5-methoxyphenyl]methylidene]-3-[(4-chlorophenyl)methyl]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=CC(=C(N1C2=CC=C(C=C2)Cl)C)/C=C\3/C(=O)N(C(=O)S3)CC4=CC=C(C=C4)Cl

DOS

IR

Vibrations