Geometry & MOs

Info

ID:	87520
PubChem CID:	49895183
Reduced:	NSCl2O4H17C25 (1)
Stoich.:	ABC2D4E17F25 (1)
Weight, g/mol:	486.161329
ΔH_f, kcal/mol:	-92.72
Dipole, Da:	3.13
IP(EA), eV:	-9.32(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,4-dimethylphenyl)-2-[2-[(Z)-[3-[(3-methylphenyl)methyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]phenoxy]acetamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)CN2C(=O)/C(=C/C3=CC(=CC=C3)OC(=O)C4=C(C=C(C=C4)Cl)Cl)/SC2=O

DOS

IR

Vibrations