Geometry & MOs

Info

ID:	88115
PubChem CID:	49901587
Reduced:	NSCl2O5H15C23 (1)
Stoich.:	ABC2D5E15F23 (1)
Weight, g/mol:	526.052084
ΔH_f, kcal/mol:	-129.73
Dipole, Da:	2.14
IP(EA), eV:	-9.39(-1.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C(=O)O)C2=CC=C(O2)/C=C\3/C(=O)N(C(=O)S3)CC4=CC(=C(C=C4)Cl)Cl

DOS

IR

Vibrations