Geometry & MOs

Info

ID:	284715
PubChem CID:	104063058
Reduced:	ClN2O2C15H17 (1)
Stoich.:	AB2C2D15E17 (1)
Weight, g/mol:	250.131742
ΔH_f, kcal/mol:	-30.52
Dipole, Da:	2.04
IP(EA), eV:	-8.71(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-(3-methoxypyridin-2-yl)pyrrolidine-2-carboxylate

Drug info:

PubChemData

Smile

CCCOC1=C(N=CC=C1)OC2=C(C=C(C=C2)CN)Cl

DOS

IR

Vibrations