Geometry & MOs

Info

ID:	257524
PubChem CID:	103146801
Reduced:	O2F3C14H25 (1)
Stoich.:	A2B3C14D25 (1)
Weight, g/mol:	208.071114
ΔH_f, kcal/mol:	-293.97
Dipole, Da:	4.07
IP(EA), eV:	-10.1(0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,2,2-trifluoroethoxy)hept-6-yn-3-one

Drug info:

PubChemData

Smile

CCCCCCCCCC(=O)CCOCC(F)(F)F

DOS

IR

Vibrations