Geometry & MOs

Info

ID:	264209
PubChem CID:	103441187
Reduced:	OF2N2C15H20 (1)
Stoich.:	AB2C2D15E20 (1)
Weight, g/mol:	260.188863
ΔH_f, kcal/mol:	-135.75
Dipole, Da:	2.02
IP(EA), eV:	-9.21(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(aminomethyl)-4-methylpiperidin-1-yl]-2-(3-methylphenyl)ethanone

Drug info:

PubChemData

Smile

CC1CCN(C(C1)CN)C(=O)CC2=C(C=C(C=C2)F)F

DOS

IR

Vibrations