Geometry & MOs

Info

ID:	21278
PubChem CID:	587829
Reduced:	NF3O3C10H16 (1)
Stoich.:	AB3C3D10E16 (1)
Weight, g/mol:	255.108228
ΔH_f, kcal/mol:	-305.52
Dipole, Da:	6.02
IP(EA), eV:	-10.39(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

butyl 3-[methyl-(2,2,2-trifluoroacetyl)amino]propanoate

Drug info:

PubChemData

Smile

CCCCOC(=O)CCN(C)C(=O)C(F)(F)F

DOS

IR

Vibrations