Geometry & MOs

Info

ID:	240322
PubChem CID:	93576922
Reduced:	BrON3H20C23 (1)
Stoich.:	ABC3D20E23 (1)
Weight, g/mol:	433.07897
ΔH_f, kcal/mol:	57.81
Dipole, Da:	3.73
IP(EA), eV:	-9.06(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C[C@@H](C1=CC=CC=C1)NC(=O)CN2C3=CC=CC=C3N=C2C4=CC(=CC=C4)Br

DOS

IR

Vibrations