Geometry & MOs

Info

ID:

86886

PubChem CID:

49889893

Reduced:

ClFNSO3H19C28 (1)

Stoich.:

ABCDE3F19G28 (1)

Weight, g/mol:

581.955539

ΔHf, kcal/mol:

-67.81

Dipole, Da:

6.34

IP(EA), eV:

 -8.85(-0.95)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CC(=C2/C=C\3/C(=O)N(C(=O)S3)CC4=CC=C(C=C4)F)OCC5=CC=CC=C5Cl

DOS

IR

Vibrations