Geometry & MOs

Info

ID:	89048
PubChem CID:	49958965
Reduced:	BrN2O3C19H19 (1)
Stoich.:	AB2C3D19E19 (1)
Weight, g/mol:	264.126263
ΔH_f, kcal/mol:	-28.68
Dipole, Da:	5.01
IP(EA), eV:	-8.99(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-benzhydryl-5-ethyl-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

CCC1=CC(=C(C=C1)OCC2=NN=C(O2)CC3=CC=C(C=C3)OC)Br

DOS

IR

Vibrations