Geometry & MOs

Info

ID:	259235
PubChem CID:	103162196
Reduced:	ClN2O2C16H19 (1)
Stoich.:	AB2C2D16E19 (1)
Weight, g/mol:	200.071641
ΔH_f, kcal/mol:	-25.93
Dipole, Da:	4.07
IP(EA), eV:	-9.92(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-chloroethyl)-5-(cyclobutylmethyl)-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

CCOC1CC(C1)CC2=NN=C(O2)C(C3=CC=CC=C3)Cl

DOS

IR

Vibrations