Geometry & MOs

Info

ID:	263285
PubChem CID:	103352424
Reduced:	OCl2N2C15H20 (1)
Stoich.:	AB2C2D15E20 (1)
Weight, g/mol:	261.184112
ΔH_f, kcal/mol:	-52.14
Dipole, Da:	4.15
IP(EA), eV:	-9.27(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(aminomethyl)-4-ethylpiperidin-1-yl]-2-pyridin-2-ylethanone

Drug info:

PubChemData

Smile

CCC1CCN(C(C1)CN)C(=O)C2=CC(=C(C=C2)Cl)Cl

DOS

IR

Vibrations