Geometry & MOs

Info

ID:	136046
PubChem CID:	51970736
Reduced:	ON3C16H25 (1)
Stoich.:	AB3C16D25 (1)
Weight, g/mol:	262.191937
ΔH_f, kcal/mol:	-24.73
Dipole, Da:	1.97
IP(EA), eV:	-8.74(0.0)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[(1S)-1-[1-(3-methoxypropyl)benzimidazol-2-yl]-2-methylpropyl]azanium

Drug info:

PubChemData

Smile

CCOCCCN1C2=CC=CC=C2N=C1[C@H](C(C)C)N

DOS

IR

Vibrations