Geometry & MOs

Info

ID:	340868
PubChem CID:	127263303
Reduced:	ClNOC13H20 (1)
Stoich.:	ABCD13E20 (1)
Weight, g/mol:	216.077789
ΔH_f, kcal/mol:	-89.68
Dipole, Da:	6.33
IP(EA), eV:	-9.14(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-piperazin-1-ylpyrimidin-5-ol;hydrochloride

Drug info:

PubChemData

Smile

CCCN[C@H]1CCC2=C(C1)C=CC=C2O.Cl

DOS

IR

Vibrations