Geometry & MOs

Info

ID:

87058

PubChem CID:

49891400

Reduced:

FSN2O4H25C30 (1)

Stoich.:

ABC2D4E25F30 (1)

Weight, g/mol:

632.02782

ΔHf, kcal/mol:

-102.37

Dipole, Da:

9.3

IP(EA), eV:

 -8.58(-0.83)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[4-[(Z)-[3-[(4-fluorophenyl)methyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]-2-iodo-6-methoxyphenoxy]-N-(3-methylphenyl)acetamide

Drug info:

PubChemData

Smile

CC1=CC(=C(N1C2=CC=C(C=C2)OC3=CC=C(C=C3)OC)C)/C=C\4/C(=O)N(C(=O)S4)CC5=CC=C(C=C5)F

DOS

IR

Vibrations