Geometry & MOs

Info

ID:	86705
PubChem CID:	49888538
Reduced:	ClSN2O2H19C24 (1)
Stoich.:	ABC2D2E19F24 (1)
Weight, g/mol:	546.94113
ΔH_f, kcal/mol:	2.79
Dipole, Da:	4.73
IP(EA), eV:	-8.47(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN(C1=CC=CC=C1)C2=CC=C(C=C2)/C=C\3/C(=O)N(C(=O)S3)CC4=CC=C(C=C4)Cl

DOS

IR

Vibrations