Geometry & MOs

Info

ID:	36082
PubChem CID:	7980743
Reduced:	NO3H19C21 (1)
Stoich.:	AB3C19D21 (1)
Weight, g/mol:	369.157623
ΔH_f, kcal/mol:	-80.33
Dipole, Da:	4.58
IP(EA), eV:	-8.7(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-[2-(naphthalene-2-carbonyloxy)acetyl]piperidine-4-carboxylate

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)NC(=O)COC(=O)C2=CC3=CC=CC=C3C=C2)C

DOS

IR

Vibrations