Geometry & MOs

Info

ID:	200947
PubChem CID:	79465510
Reduced:	SO3N4C10H12 (1)
Stoich.:	AB3C4D10E12 (1)
Weight, g/mol:	212.188863
ΔH_f, kcal/mol:	9.81
Dipole, Da:	4.45
IP(EA), eV:	-9.5(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(3-aminocyclopentyl)piperidin-2-yl]ethanol

Drug info:

PubChemData

Smile

C1CC(CC1N)OC2=C(N3C=CSC3=N2)[N+](=O)[O-]

DOS

IR

Vibrations