Geometry & MOs

Info

ID:	263419
PubChem CID:	103366287
Reduced:	N2F3C12H23 (1)
Stoich.:	A2B3C12D23 (1)
Weight, g/mol:	256.139862
ΔH_f, kcal/mol:	-196.7
Dipole, Da:	3.93
IP(EA), eV:	-9.04(1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[[2-(aminomethyl)-3,3,3-trifluoropropyl]-ethylamino]propanoate

Drug info:

PubChemData

Smile

CCCC1CCN(CC1)CC(CN)C(F)(F)F

DOS

IR

Vibrations