Geometry & MOs

Info

ID:	405071
PubChem CID:	135072392
Reduced:	O2H9C11 (2)
Stoich.:	A2B9C11 (2)
Weight, g/mol:	376.142307
ΔH_f, kcal/mol:	-32.93
Dipole, Da:	3.49
IP(EA), eV:	-9.42(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC(=O)C(CC#CC1=CC=CC=C1)(CC#CC2=CC=CC=C2)C(=O)O

DOS

IR

Vibrations