Geometry & MOs

Info

ID:	240261
PubChem CID:	93576732
Reduced:	ON3C28H31 (1)
Stoich.:	AB3C28D31 (1)
Weight, g/mol:	425.246713
ΔH_f, kcal/mol:	19.92
Dipole, Da:	2.97
IP(EA), eV:	-8.96(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-2-[2-[(1S)-1-[4-(2-methylpropyl)phenyl]ethyl]benzimidazol-1-yl]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