Geometry & MOs

Info

ID:

86805

PubChem CID:

49889457

Reduced:

INSCl2O5H18C26 (1)

Stoich.:

ABCD2E5F18G26 (1)

Weight, g/mol:

540.067734

ΔHf, kcal/mol:

-110.04

Dipole, Da:

1.89

IP(EA), eV:

 -9.23(-1.51)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC1=C(C(=CC(=C1)/C=C\2/C(=O)N(C(=O)S2)CC3=C(C=C(C=C3)Cl)Cl)I)OC(=O)C4=CC=CC=C4

DOS

IR

Vibrations