Geometry & MOs

Info

ID:	87457
PubChem CID:	49894772
Reduced:	NSO4H17C19 (1)
Stoich.:	ABC4D17E19 (1)
Weight, g/mol:	325.077265
ΔH_f, kcal/mol:	-106.24
Dipole, Da:	2.34
IP(EA), eV:	-8.82(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CN2C(=O)/C(=C/C3=CC(=C(C=C3)OC)O)/SC2=O

DOS

IR

Vibrations