Geometry & MOs

Info

ID:	89043
PubChem CID:	49958882
Reduced:	N2O3H22C25 (1)
Stoich.:	A2B3C22D25 (1)
Weight, g/mol:	368.188863
ΔH_f, kcal/mol:	23.57
Dipole, Da:	7.46
IP(EA), eV:	-8.51(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-benzhydryl-5-(4-tert-butylphenyl)-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)/C=C/C2=NN=C(O2)C(C3=CC=CC=C3)C4=CC=CC=C4)OC

DOS

IR

Vibrations