Geometry & MOs

Info

ID:	250422
PubChem CID:	103096476
Reduced:	N3O3C9H11 (1)
Stoich.:	A3B3C9D11 (1)
Weight, g/mol:	158.069142
ΔH_f, kcal/mol:	-5.17
Dipole, Da:	4.12
IP(EA), eV:	-10.8(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-hydroxybutyl)-2H-1,2,4-oxadiazol-5-one

Drug info:

PubChemData

Smile

CCCC(C1=NOC(=N1)C2=NOC=C2)O

DOS

IR

Vibrations