Geometry & MOs

Info

ID:	345239
PubChem CID:	127269303
Reduced:	ON4C12H18 (1)
Stoich.:	AB4C12D18 (1)
Weight, g/mol:	374.231791
ΔH_f, kcal/mol:	-12.77
Dipole, Da:	3.39
IP(EA), eV:	-8.94(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(dimethylamino)piperidin-1-yl]-2-[1-(3-hydroxypyridine-2-carbonyl)piperidin-4-yl]ethanone

Drug info:

PubChemData

Smile

C1CCN2CCN(CC2C1)C(=O)C3=CN=CN3

DOS

IR

Vibrations