Geometry & MOs

Info

ID:	240262
PubChem CID:	93576733
Reduced:	ON3C28H31 (1)
Stoich.:	AB3C28D31 (1)
Weight, g/mol:	439.262363
ΔH_f, kcal/mol:	22.07
Dipole, Da:	3.77
IP(EA), eV:	-8.97(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[(1R)-1-[4-(2-methylpropyl)phenyl]ethyl]benzimidazol-1-yl]-N-[(1R)-1-phenylethyl]acetamide

Drug info:

PubChemData

Smile

C[C@@H](C1=CC=C(C=C1)CC(C)C)C2=NC3=CC=CC=C3N2CC(=O)NCC4=CC=CC=C4

DOS

IR

Vibrations