Geometry & MOs

Info

ID:	259351
PubChem CID:	103164490
Reduced:	BrON3C13H16 (1)
Stoich.:	ABC3D13E16 (1)
Weight, g/mol:	308.05243
ΔH_f, kcal/mol:	15.14
Dipole, Da:	6.54
IP(EA), eV:	-9.4(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-bromo-2-[(3-ethoxycyclobutyl)methyl]-1H-benzimidazole

Drug info:

PubChemData

Smile

CCOC1CC(C1)CC2=NC3=C(N2)C=C(C=N3)Br

DOS

IR

Vibrations