Geometry & MOs

Info

ID:	240321
PubChem CID:	93576921
Reduced:	BrON3C19H20 (1)
Stoich.:	ABC3D19E20 (1)
Weight, g/mol:	433.07897
ΔH_f, kcal/mol:	15.1
Dipole, Da:	4.87
IP(EA), eV:	-9.19(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(3-bromophenyl)benzimidazol-1-yl]-N-[(1S)-1-phenylethyl]acetamide

Drug info:

PubChemData

Smile

CC[C@H](C)NC(=O)CN1C2=CC=CC=C2N=C1C3=CC(=CC=C3)Br

DOS

IR

Vibrations