Geometry & MOs

Info

ID:	240313
PubChem CID:	93576905
Reduced:	O2N3C20H21 (1)
Stoich.:	A2B3C20D21 (1)
Weight, g/mol:	321.184112
ΔH_f, kcal/mol:	-17.82
Dipole, Da:	3.7
IP(EA), eV:	-8.96(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-butan-2-yl]-2-[2-(2-methylphenyl)benzimidazol-1-yl]acetamide

Drug info:

PubChemData

Smile

C1C[C@@H](OC1)CNC(=O)CN2C3=CC=CC=C3N=C2C4=CC=CC=C4

DOS

IR

Vibrations