Geometry & MOs

Info

ID:	413863
PubChem CID:	135086814
Reduced:	NOC10H17 (1)
Stoich.:	ABC10D17 (1)
Weight, g/mol:	244.055858
ΔH_f, kcal/mol:	-35.46
Dipole, Da:	3.34
IP(EA), eV:	-8.81(1.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,2-diethoxyacetyl) 2,2,2-trifluoroacetate

Drug info:

PubChemData

Smile

C1CCN2[C@]3(C1)CCC[C@@H]3CO2

DOS

IR

Vibrations