Geometry & MOs

Info

ID:

87999

PubChem CID:

49899545

Reduced:

BrNSCl3O3H15C24 (1)

Stoich.:

ABCD3E3F15G24 (1)

Weight, g/mol:

556.062648

ΔHf, kcal/mol:

-47.61

Dipole, Da:

5.44

IP(EA), eV:

 -9.14(-1.26)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)COC2=C(C=C(C=C2)Br)/C=C\3/C(=O)N(C(=O)S3)CC4=C(C=CC=C4Cl)Cl)Cl

DOS

IR

Vibrations