Geometry & MOs

Info

ID:	251076
PubChem CID:	103101294
Reduced:	BrON3C13H20 (1)
Stoich.:	ABC3D13E20 (1)
Weight, g/mol:	261.15896
ΔH_f, kcal/mol:	-26.11
Dipole, Da:	3.02
IP(EA), eV:	-8.81(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(6-amino-1H-benzimidazol-2-yl)ethyl-ethylamino]acetamide

Drug info:

PubChemData

Smile

CCN(CC(=O)N)C(C1=CC=CC=C1Br)C(C)N

DOS

IR

Vibrations