Geometry & MOs

Info

ID:	342472
PubChem CID:	127265627
Reduced:	ON3H15C18 (1)
Stoich.:	AB3C15D18 (1)
Weight, g/mol:	231.162314
ΔH_f, kcal/mol:	78.24
Dipole, Da:	4.3
IP(EA), eV:	-8.98(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methyl-3-phenylprop-2-enyl)piperidin-3-ol

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C=CC2=NC=NC=C2)OCC3=CN=CC=C3

DOS

IR

Vibrations