Geometry & MOs

Info

ID:	88067
PubChem CID:	49900449
Reduced:	SCl2N4O6H24C25 (1)
Stoich.:	AB2C4D6E24F25 (1)
Weight, g/mol:	466.015698
ΔH_f, kcal/mol:	-110.66
Dipole, Da:	3.47
IP(EA), eV:	-9.3(-1.38)
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]-2-methoxyphenoxy]acetamide

Drug info:

PubChemData

Smile

C1COCCN1C2=CC(=C(C=C2/C=C\3/C(=O)N(C(=O)S3)CC4=C(C=CC=C4Cl)Cl)[N+](=O)[O-])N5CCOCC5

DOS

IR

Vibrations