Geometry & MOs

Info

ID:	171086
PubChem CID:	75325873
Reduced:	NCl2S2O5H17C24 (1)
Stoich.:	AB2C2D5E17F24 (1)
Weight, g/mol:	620.92766
ΔH_f, kcal/mol:	-134.99
Dipole, Da:	8.31
IP(EA), eV:	-8.96(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[4-[[3-[(2,6-dichlorophenyl)methyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]-2-ethoxy-6-iodophenoxy]acetate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C=C3C(=O)N(C(=O)S3)CC4=C(C=CC=C4Cl)Cl

DOS

IR

Vibrations