Geometry & MOs

Info

ID:	257553
PubChem CID:	103146982
Reduced:	N2O2F3C10H11 (1)
Stoich.:	A2B2C3D10E11 (1)
Weight, g/mol:	290.076593
ΔH_f, kcal/mol:	-210.87
Dipole, Da:	2.5
IP(EA), eV:	-9.63(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2,2,2-trifluoroethoxy)propan-1-one

Drug info:

PubChemData

Smile

C1=CN=CC(=C1N)C(=O)CCOCC(F)(F)F

DOS

IR

Vibrations