Geometry & MOs

Info

ID:	363001
PubChem CID:	127310022
Reduced:	N2F3O3C15H15 (1)
Stoich.:	A2B3C3D15E15 (1)
Weight, g/mol:	307.114376
ΔH_f, kcal/mol:	-258.82
Dipole, Da:	2.71
IP(EA), eV:	-9.59(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-oxo-N-[2-oxo-1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]piperidine-3-carboxamide

Drug info:

PubChemData

Smile

C1CN(C(=O)C1NC(=O)C2=CC3=C(COC3)C=C2)CC(F)(F)F

DOS

IR

Vibrations