Geometry & MOs

Info

ID:	21425
PubChem CID:	588188
Reduced:	OH8C11 (2)
Stoich.:	AB8C11 (2)
Weight, g/mol:	312.11503
ΔH_f, kcal/mol:	-2.01
Dipole, Da:	2.04
IP(EA), eV:	-8.85(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

naphthalen-1-ylmethyl naphthalene-2-carboxylate

Drug info:

PubChemData

Smile

C1=CC=C2C=C(C=CC2=C1)C(=O)OCC3=CC=CC4=CC=CC=C43

DOS

IR

Vibrations