Geometry & MOs

Info

ID:	35991
PubChem CID:	7980605
Reduced:	N2O3H22C23 (1)
Stoich.:	A2B3C22D23 (1)
Weight, g/mol:	344.116092
ΔH_f, kcal/mol:	-50.7
Dipole, Da:	3.63
IP(EA), eV:	-8.22(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CN(CCN1C2=CC=CC=C2)C(=O)COC(=O)C3=CC4=CC=CC=C4C=C3

DOS

IR

Vibrations