Geometry & MOs

Info

ID:	240335
PubChem CID:	93576966
Reduced:	BrO2N3C20H20 (1)
Stoich.:	AB2C3D20E20 (1)
Weight, g/mol:	301.179027
ΔH_f, kcal/mol:	-17.68
Dipole, Da:	2.83
IP(EA), eV:	-9.22(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-butyl-2-[2-[(2R)-oxolan-2-yl]benzimidazol-1-yl]acetamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations