Geometry & MOs

Info

ID:	88934
PubChem CID:	49957875
Reduced:	N2O2H20C23 (1)
Stoich.:	A2B2C20D23 (1)
Weight, g/mol:	402.05791
ΔH_f, kcal/mol:	38.71
Dipole, Da:	3.33
IP(EA), eV:	-9.04(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)OCC2=NN=C(O2)/C=C/C3=CC=CC4=CC=CC=C43)C

DOS

IR

Vibrations