Geometry & MOs

Info

ID:	137622
PubChem CID:	52236275
Reduced:	N2O3C14H20 (1)
Stoich.:	A2B3C14D20 (1)
Weight, g/mol:	334.189257
ΔH_f, kcal/mol:	-106.36
Dipole, Da:	2.57
IP(EA), eV:	-9.43(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-[[3-(methoxymethyl)phenyl]methylcarbamoyl]piperidine-4-carboxylate

Drug info:

PubChemData

Smile

COCC1=CC=CC(=C1)CNC(=O)N2CCOCC2

DOS

IR

Vibrations