Geometry & MOs

Info

ID:	54328
PubChem CID:	17032785
Reduced:	ClO2N3H18C22 (1)
Stoich.:	AB2C3D18E22 (1)
Weight, g/mol:	429.085574
ΔH_f, kcal/mol:	14.5
Dipole, Da:	5.66
IP(EA), eV:	-8.7(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(2-chlorophenyl)benzimidazol-1-yl]-N-[3-(trifluoromethyl)phenyl]acetamide

Drug info:

PubChemData

Smile

COC1=CC=CC=C1NC(=O)CN2C3=CC=CC=C3N=C2C4=CC=CC=C4Cl

DOS

IR

Vibrations