Geometry & MOs

Info

ID:	22390
PubChem CID:	597113
Reduced:	NF3O3C11H16 (1)
Stoich.:	AB3C3D11E16 (1)
Weight, g/mol:	267.108228
ΔH_f, kcal/mol:	-300.67
Dipole, Da:	6.62
IP(EA), eV:	-10.17(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

butyl 1-(2,2,2-trifluoroacetyl)pyrrolidine-2-carboxylate

Drug info:

PubChemData

Smile

CCCCOC(=O)C1CCCN1C(=O)C(F)(F)F

DOS

IR

Vibrations