Geometry & MOs

Info

ID:	87720
PubChem CID:	49896775
Reduced:	ClNSO5H16C20 (1)
Stoich.:	ABCD5E16F20 (1)
Weight, g/mol:	493.03473
ΔH_f, kcal/mol:	-154.38
Dipole, Da:	3.41
IP(EA), eV:	-9.4(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CN2C(=O)/C(=C/C3=CC(=C(C=C3)OCC(=O)O)Cl)/SC2=O

DOS

IR

Vibrations