Geometry & MOs

Info

ID:	250370
PubChem CID:	103096102
Reduced:	NOF2H5C6 (2)
Stoich.:	ABC2D5E6 (2)
Weight, g/mol:	256.041483
ΔH_f, kcal/mol:	-211.55
Dipole, Da:	5.0
IP(EA), eV:	-10.54(-1.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-(3-chloro-2-fluorophenyl)-1,2,4-oxadiazol-3-yl]propan-1-ol

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations