Geometry & MOs

Info

ID:	87665
PubChem CID:	49896396
Reduced:	ClSN2O4H23C27 (1)
Stoich.:	ABC2D4E23F27 (1)
Weight, g/mol:	492.091056
ΔH_f, kcal/mol:	-99.56
Dipole, Da:	4.57
IP(EA), eV:	-8.96(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CN2C(=O)/C(=C/C3=CC=C(C=C3)OCC(=O)NC4=CC(=C(C=C4)C)Cl)/SC2=O

DOS

IR

Vibrations