Geometry & MOs

Info

ID:	161435
PubChem CID:	57391673
Reduced:	ON2Cl3H25C42 (1)
Stoich.:	AB2C3D25E42 (1)
Weight, g/mol:	430.129298
ΔH_f, kcal/mol:	139.97
Dipole, Da:	2.74
IP(EA), eV:	-8.93(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[4-[4-(trifluoromethyl)phenyl]phenyl]phenyl]-1H-benzimidazol-4-ol

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC(=NC3=C2C=C(C=C3)Cl)C4=CC=C(C=C4)OC5=C(C6=C(C=CC(=C6)Cl)N=C5C7=CC=C(C=C7)Cl)C8=CC=CC=C8

DOS

IR

Vibrations