Geometry & MOs

Info

ID:	88940
PubChem CID:	49957946
Reduced:	N2O3H20C22 (1)
Stoich.:	A2B3C20D22 (1)
Weight, g/mol:	310.131742
ΔH_f, kcal/mol:	-8.91
Dipole, Da:	3.74
IP(EA), eV:	-8.83(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)OCC2=NN=C(O2)COC3=CC4=CC=CC=C4C=C3)C

DOS

IR

Vibrations