Geometry & MOs

Info

ID:

11093

PubChem CID:

110893

Reduced:

ClN3O3C19H19 (2)

Stoich.:

AB3C3D19E19 (2)

Weight, g/mol:

744.222988

ΔHf, kcal/mol:

-103.41

Dipole, Da:

3.91

IP(EA), eV:

 -8.49(-1.53)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[[5-chloro-4-[2-chloro-4-[[1-(2,4-dimethylanilino)-1,3-dioxobutan-2-yl]diazenyl]-5-methoxyphenyl]-2-methoxyphenyl]diazenyl]-N-(2,4-dimethylphenyl)-3-oxobutanamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)NC(=O)C(C(=O)C)N=NC2=C(C=C(C(=C2)Cl)C3=CC(=C(C=C3Cl)N=NC(C(=O)C)C(=O)NC4=C(C=C(C=C4)C)C)OC)OC)C

DOS

IR

Vibrations