Geometry & MOs

Info

ID:

87992

PubChem CID:

49899449

Reduced:

ClSN2O4H21C29 (1)

Stoich.:

ABC2D4E21F29 (1)

Weight, g/mol:

606.91201

ΔHf, kcal/mol:

-61.0

Dipole, Da:

1.95

IP(EA), eV:

 -8.99(-1.48)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

methyl 2-[4-[(Z)-[3-[(3,4-dichlorophenyl)methyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]-2-iodo-6-methoxyphenoxy]acetate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)NC(=O)COC2=C(C=C(C=C2)/C=C\3/C(=O)N(C(=O)S3)CC4=CC5=CC=CC=C5C=C4)Cl

DOS

IR

Vibrations