Geometry & MOs

Info

ID:	260931
PubChem CID:	103209992
Reduced:	F2N2O2C15H18 (1)
Stoich.:	A2B2C2D15E18 (1)
Weight, g/mol:	252.035791
ΔH_f, kcal/mol:	-140.81
Dipole, Da:	2.85
IP(EA), eV:	-8.82(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-[5-(2,2,2-trifluoroethoxymethyl)-1,3,4-oxadiazol-2-yl]prop-2-enoic acid

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C#CCN)NC(=O)CCOCC(F)F

DOS

IR

Vibrations