Geometry & MOs

Info

ID:	268725
PubChem CID:	103600659
Reduced:	N2F3O3H5C8 (1)
Stoich.:	A2B3C3D5E8 (1)
Weight, g/mol:	235.102
ΔH_f, kcal/mol:	-162.24
Dipole, Da:	6.81
IP(EA), eV:	-9.96(-1.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-(2,2-difluoroacetyl)piperidine-3-carboxylate

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1NC(=O)C(F)F)[N+](=O)[O-])F

DOS

IR

Vibrations