Geometry & MOs

Info

ID:	258112
PubChem CID:	103151084
Reduced:	F2O2N3C14H23 (1)
Stoich.:	A2B2C3D14E23 (1)
Weight, g/mol:	289.067426
ΔH_f, kcal/mol:	-129.93
Dipole, Da:	4.81
IP(EA), eV:	-9.4(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2E)-2-[3-[2-(2,2,2-trifluoroethoxy)ethyl]-2H-1,2,4-oxadiazol-5-ylidene]pyridin-3-one

Drug info:

PubChemData

Smile

CCCNC(CC1=NC(=NO1)CCOCC(F)F)C2CC2

DOS

IR

Vibrations