Geometry & MOs

Info

ID:

313139

PubChem CID:

126612172

Reduced:

NO3H41C64 (1)

Stoich.:

AB3C41D64 (1)

Weight, g/mol:

453.045397

ΔHf, kcal/mol:

185.6

Dipole, Da:

2.78

IP(EA), eV:

 -7.92(-0.92)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-chloro-N-(2,5-dichlorophenyl)-2-methoxy-N-(2-phenylphenyl)aniline

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC(=CC(=C3N4C5=C(C=CC(=C5)C6=CC7=CC=CC=C7O6)OC8=C4C=C(C=C8)C9=CC1=CC=CC=C1O9)C1=CC=C(C=C1)C1=CC=CC=C1)C1=CC=CC=C1

DOS

IR

Vibrations