Geometry & MOs

Info

ID:	281859
PubChem CID:	103914470
Reduced:	ON4C11H18 (1)
Stoich.:	AB4C11D18 (1)
Weight, g/mol:	254.18167
ΔH_f, kcal/mol:	-16.67
Dipole, Da:	6.72
IP(EA), eV:	-9.03(0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methylpropyl)-N-(2-prop-2-ynylsulfanylethyl)piperidin-4-amine

Drug info:

PubChemData

Smile

CC(C1=NC=CN1C)NC2CCN(C2=O)C

DOS

IR

Vibrations