Geometry & MOs

Info

ID:	426613
PubChem CID:	135152005
Reduced:	SN2O5C26H28 (1)
Stoich.:	AB2C5D26E28 (1)
Weight, g/mol:	269.087492
ΔH_f, kcal/mol:	-112.02
Dipole, Da:	9.62
IP(EA), eV:	-9.38(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-(2,2,2-trifluoroacetyl)oxypiperidine-4-carboxylate

Drug info:

PubChemData

Smile

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)COC3=COC(=CC3=O)CN4CC5=CC=CC=C5C4

DOS

IR

Vibrations