Geometry & MOs

Info

ID:	250402
PubChem CID:	103096337
Reduced:	N2O2C13H16 (1)
Stoich.:	A2B2C13D16 (1)
Weight, g/mol:	267.065534
ΔH_f, kcal/mol:	-23.32
Dipole, Da:	4.01
IP(EA), eV:	-9.48(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-(5-fluoro-2-nitrophenyl)-1,2,4-oxadiazol-3-yl]propan-1-ol

Drug info:

PubChemData

Smile

CCC(C1=NOC(=N1)CC2=CC=C(C=C2)C)O

DOS

IR

Vibrations