Geometry & MOs

Info

ID:	89185
PubChem CID:	49959821
Reduced:	N2O3H18C21 (1)
Stoich.:	A2B3C18D21 (1)
Weight, g/mol:	360.147393
ΔH_f, kcal/mol:	3.55
Dipole, Da:	3.41
IP(EA), eV:	-8.76(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3,5-dimethylphenoxy)methyl]-5-(naphthalen-1-yloxymethyl)-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)OCC2=NN=C(O2)COC3=CC=CC4=CC=CC=C43

DOS

IR

Vibrations