Geometry & MOs

Info

ID:

180947

PubChem CID:

76709546

Reduced:

OCl2F3N4H25C34 (1)

Stoich.:

AB2C3D4E25F34 (1)

Weight, g/mol:

753.069052

ΔHf, kcal/mol:

-64.43

Dipole, Da:

7.95

IP(EA), eV:

 -8.84(-0.89)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[4-[[4-(2,4-dichlorophenyl)-2-[2-[4-[4-(trifluoromethyl)phenyl]phenyl]ethenyl]imidazol-1-yl]methyl]-N-(trifluoromethylsulfonyl)anilino]acetic acid

Drug info:

PubChemData

Smile

C1C(NNC1=O)C2=CC=C(C=C2)CN3C=C(N=C3C=CC4=CC=C(C=C4)C5=CC(=CC=C5)C(F)(F)F)C6=C(C=C(C=C6)Cl)Cl

DOS

IR

Vibrations