Geometry & MOs

Info

ID:

86856

PubChem CID:

49889757

Reduced:

FSN3O5H22C29 (1)

Stoich.:

ABC3D5E22F29 (1)

Weight, g/mol:

556.062648

ΔHf, kcal/mol:

-135.93

Dipole, Da:

3.76

IP(EA), eV:

 -8.7(-1.22)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[4-[(Z)-[3-[(2,4-dichlorophenyl)methyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]-2-ethoxyphenoxy]-N-phenylacetamide

Drug info:

PubChemData

Smile

CC1=C(C2=CC=CC=C2N1CC(=O)NC3=CC4=C(C=C3)OCO4)/C=C\5/C(=O)N(C(=O)S5)CC6=CC=C(C=C6)F

DOS

IR

Vibrations