Geometry & MOs

Info

ID:	402373
PubChem CID:	135055725
Reduced:	ClON2F3C13H14 (1)
Stoich.:	ABC2D3E13F14 (1)
Weight, g/mol:	322.129298
ΔH_f, kcal/mol:	-182.9
Dipole, Da:	5.2
IP(EA), eV:	-9.28(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,5-dimethyl-1-(2,2,2-trifluoro-1-naphthalen-2-ylethyl)pyrazolidin-3-one

Drug info:

PubChemData

Smile

CC1(CC(=O)NN1C(C2=CC=C(C=C2)Cl)C(F)(F)F)C

DOS

IR

Vibrations