Geometry & MOs

Info

ID:	260983
PubChem CID:	103213021
Reduced:	F2N2O3C12H22 (1)
Stoich.:	A2B2C3D12E22 (1)
Weight, g/mol:	268.139862
ΔH_f, kcal/mol:	-252.49
Dipole, Da:	3.75
IP(EA), eV:	-9.39(0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(2-aminoethyl)pyrrolidin-1-yl]-3-(2,2,2-trifluoroethoxy)propan-1-one

Drug info:

PubChemData

Smile

CC1(CN(CC(O1)CN)C(=O)CCOCC(F)F)C

DOS

IR

Vibrations