Geometry & MOs

Info

ID:	21899
PubChem CID:	593265
Reduced:	N2O5H18C26 (1)
Stoich.:	A2B5C18D26 (1)
Weight, g/mol:	438.121572
ΔH_f, kcal/mol:	-26.46
Dipole, Da:	5.62
IP(EA), eV:	-9.26(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(naphthalene-1-carbonyloxymethyl)-1,2,5-oxadiazol-3-yl]methyl naphthalene-1-carboxylate

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CC=C2C(=O)OCC3=NON=C3COC(=O)C4=CC=CC5=CC=CC=C54

DOS

IR

Vibrations