Geometry & MOs

Info

ID:	205420
PubChem CID:	80097535
Reduced:	NO3C17H17 (1)
Stoich.:	AB3C17D17 (1)
Weight, g/mol:	287.152144
ΔH_f, kcal/mol:	-42.17
Dipole, Da:	5.31
IP(EA), eV:	-8.65(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-(4-methoxynaphthalen-1-yl)-3-(methylamino)propanoate

Drug info:

PubChemData

Smile

COC1=CC=C(C2=CC=CC=C21)CN(CC#C)CC(=O)O

DOS

IR

Vibrations