Geometry & MOs

Info

ID:	405072
PubChem CID:	135072394
Reduced:	NO2H10C11 (2)
Stoich.:	AB2C10D11 (2)
Weight, g/mol:	376.142307
ΔH_f, kcal/mol:	-87.58
Dipole, Da:	1.27
IP(EA), eV:	-8.78(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dibenzyl 2-(3-aminopyridin-4-yl)propanedioate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COC(=O)C(C2=C(C=CC=N2)N)C(=O)OCC3=CC=CC=C3

DOS

IR

Vibrations