Geometry & MOs

Info

ID:	165306
PubChem CID:	74529514
Reduced:	SN2O4C22H22 (1)
Stoich.:	AB2C4D22E22 (1)
Weight, g/mol:	402.044106
ΔH_f, kcal/mol:	-109.21
Dipole, Da:	4.12
IP(EA), eV:	-9.28(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-chloro-2-hydroxyphenyl)-2-[5-[(2-methylphenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C=C2C(=O)N(C(=O)S2)CC(=O)N(CCO)CC3=CC=CC=C3

DOS

IR

Vibrations