Geometry & MOs

Info

ID:	88961
PubChem CID:	49958241
Reduced:	NOC10H10 (2)
Stoich.:	ABC10D10 (2)
Weight, g/mol:	338.163043
ΔH_f, kcal/mol:	14.53
Dipole, Da:	4.51
IP(EA), eV:	-9.14(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-methylphenoxy)methyl]-5-[(4-propan-2-ylphenoxy)methyl]-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)/C=C/C2=NN=C(O2)COC3=C(C=CC=C3C)C

DOS

IR

Vibrations