Geometry & MOs

Info

ID:

88069

PubChem CID:

49900461

Reduced:

NSCl2O5H21C27 (1)

Stoich.:

ABC2D5E21F27 (1)

Weight, g/mol:

570.078298

ΔHf, kcal/mol:

-136.34

Dipole, Da:

5.49

IP(EA), eV:

 -8.88(-1.2)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC1=C(C=CC(=C1)/C=C\2/C(=O)N(C(=O)S2)CC3=C(C=CC=C3Cl)Cl)OC(=O)C4=CC=C(C=C4)C

DOS

IR

Vibrations