Geometry & MOs

Info

ID:	88932
PubChem CID:	49957866
Reduced:	NOC10H10 (2)
Stoich.:	ABC10D10 (2)
Weight, g/mol:	232.121178
ΔH_f, kcal/mol:	15.6
Dipole, Da:	3.89
IP(EA), eV:	-8.65(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)/C=C/C2=NN=C(O2)COC3=C(C=C(C=C3)C)C

DOS

IR

Vibrations