Geometry & MOs

Info

ID:	201042
PubChem CID:	79480245
Reduced:	O2N3C16H21 (1)
Stoich.:	A2B3C16D21 (1)
Weight, g/mol:	306.07712
ΔH_f, kcal/mol:	-45.08
Dipole, Da:	5.13
IP(EA), eV:	-9.25(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]cyclobutane-1-carboxylate

Drug info:

PubChemData

Smile

CCCN1C2=C(C=NC=C2)N=C1C3(CCC3)C(=O)OCC

DOS

IR

Vibrations