Geometry & MOs

Info

ID:	66015
PubChem CID:	46488122
Reduced:	ClOSN2H17C18 (1)
Stoich.:	ABCD2E17F18 (1)
Weight, g/mol:	335.088161
ΔH_f, kcal/mol:	12.14
Dipole, Da:	6.03
IP(EA), eV:	-9.25(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1H-benzimidazol-2-yl)-2-[4-(trifluoromethoxy)phenyl]acetamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CCNC(=O)CSCC2=CC=C(C=C2)C#N)Cl

DOS

IR

Vibrations