Geometry & MOs

Info

ID:	130675
PubChem CID:	51091981
Reduced:	O2F3N3C15H18 (1)
Stoich.:	A2B3C3D15E18 (1)
Weight, g/mol:	341.135111
ΔH_f, kcal/mol:	-231.13
Dipole, Da:	4.49
IP(EA), eV:	-9.56(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(3-cyanophenoxy)ethyl]-N-(2,2,2-trifluoroethyl)pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C1CC(N(C1)CC2=CC(=CC=C2)C(=O)N)C(=O)NCC(F)(F)F

DOS

IR

Vibrations