Geometry & MOs

Info

ID:	130674
PubChem CID:	51091979
Reduced:	N2F3O3C16H19 (1)
Stoich.:	A2B3C3D16E19 (1)
Weight, g/mol:	329.135111
ΔH_f, kcal/mol:	-273.83
Dipole, Da:	4.87
IP(EA), eV:	-9.6(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3-carbamoylphenyl)methyl]-N-(2,2,2-trifluoroethyl)pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

COC(=O)C1=CC=CC(=C1)CN2CCCC2C(=O)NCC(F)(F)F

DOS

IR

Vibrations