Geometry & MOs

Info

ID:	89057
PubChem CID:	49959022
Reduced:	IN2O3H15C17 (1)
Stoich.:	AB2C3D15E17 (1)
Weight, g/mol:	424.04226
ΔH_f, kcal/mol:	-7.24
Dipole, Da:	2.5
IP(EA), eV:	-8.9(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CC2=NN=C(O2)C3=CC(=C(C=C3)OC)I

DOS

IR

Vibrations