Geometry & MOs

Info

ID:	430411
PubChem CID:	135170475
Reduced:	O3N4H22C24 (1)
Stoich.:	A3B4C22D24 (1)
Weight, g/mol:	158.02469
ΔH_f, kcal/mol:	-30.24
Dipole, Da:	9.7
IP(EA), eV:	-8.93(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(1-chlorocyclopropyl)-3-methyl-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

CC1=C(C2=CC=CC=C2N1C3=NC4=C(COCC4)C(=N3)NCC5=CC=CC=C5)C(=O)O

DOS

IR

Vibrations