Geometry & MOs

Info

ID:	54901
PubChem CID:	17389511
Reduced:	S2N3O4C9H9 (1)
Stoich.:	A2B3C4D9E9 (1)
Weight, g/mol:	263.059217
ΔH_f, kcal/mol:	-86.14
Dipole, Da:	5.77
IP(EA), eV:	-9.63(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1H-benzimidazol-2-ylmethoxy)ethanamine;dihydrochloride

Drug info:

PubChemData

Smile

C1=CC(=CC=C1OCC2=NN=C(S2)N)S(=O)(=O)O

DOS

IR

Vibrations