Geometry & MOs

Info

ID:	76288
PubChem CID:	48424737
Reduced:	ON2C9H12 (2)
Stoich.:	AB2C9D12 (2)
Weight, g/mol:	347.220892
ΔH_f, kcal/mol:	-10.44
Dipole, Da:	5.21
IP(EA), eV:	-8.76(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-[(1-ethylpiperidin-4-yl)methylamino]-1-oxo-3-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C(=O)N1CCCN(CC1)C2=C(C=CC=N2)C#N)OCC3CC3

DOS

IR

Vibrations