Geometry & MOs

Info

ID:	265967
PubChem CID:	103557133
Reduced:	BrON2C13H15 (1)
Stoich.:	ABC2D13E15 (1)
Weight, g/mol:	246.136828
ΔH_f, kcal/mol:	2.42
Dipole, Da:	3.57
IP(EA), eV:	-9.12(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methoxy-2-[(1-methoxycyclobutyl)methyl]-1H-benzimidazole

Drug info:

PubChemData

Smile

COC1(CCC1)CC2=NC3=C(N2)C=C(C=C3)Br

DOS

IR

Vibrations