Geometry & MOs

Info

ID:	50672
PubChem CID:	12013246
Reduced:	N2O3C15H18 (1)
Stoich.:	A2B3C15D18 (1)
Weight, g/mol:	304.178693
ΔH_f, kcal/mol:	-113.99
Dipole, Da:	6.29
IP(EA), eV:	-9.04(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[2-amino-1-(4-methylphenyl)-2-oxoethyl]piperidine-1-carboxylate

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)[C@H]2[C@@H]3CCCCN3C(=O)NC2=O

DOS

IR

Vibrations