Geometry & MOs

Info

ID:	313597
PubChem CID:	126616257
Reduced:	SCl2O2N3H19C26 (1)
Stoich.:	AB2C2D3E19F26 (1)
Weight, g/mol:	598.140168
ΔH_f, kcal/mol:	36.62
Dipole, Da:	5.31
IP(EA), eV:	-9.3(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[bis(4-chlorophenyl)methyl]-2-methyl-1-[(2S)-2-phenylpropyl]benzimidazole;2,2,2-trifluoroacetic acid

Drug info:

PubChemData

Smile

CCOC(=O)C1=NC2=C(N1C3=CC(=CC=C3)Cl)C=C(C=C2)C(C4=CC=C(C=C4)Cl)C5=NC=CS5

DOS

IR

Vibrations