Geometry & MOs

Info

ID:	15324
PubChem CID:	438029
Reduced:	O3H12C14 (2)
Stoich.:	A3B12C14 (2)
Weight, g/mol:	456.157288
ΔH_f, kcal/mol:	-142.3
Dipole, Da:	5.77
IP(EA), eV:	-8.69(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl 1,4-bis(phenylmethoxy)naphthalene-2,3-dicarboxylate

Drug info:

PubChemData

Smile

COC(=O)C1=C(C2=CC=CC=C2C(=C1C(=O)OC)OCC3=CC=CC=C3)OCC4=CC=CC=C4

DOS

IR

Vibrations