Geometry & MOs

Info

ID:	240334
PubChem CID:	93576961
Reduced:	Cl2O2N3H19C20 (1)
Stoich.:	A2B2C3D19E20 (1)
Weight, g/mol:	413.07389
ΔH_f, kcal/mol:	-34.78
Dipole, Da:	5.91
IP(EA), eV:	-9.12(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(4-bromophenyl)benzimidazol-1-yl]-N-[[(2S)-oxolan-2-yl]methyl]acetamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations