Geometry & MOs

Info

ID:	201405
PubChem CID:	79535478
Reduced:	BrON2C10H15 (1)
Stoich.:	ABC2D10E15 (1)
Weight, g/mol:	306.155512
ΔH_f, kcal/mol:	-26.43
Dipole, Da:	2.27
IP(EA), eV:	-8.5(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(2-oxocyclopentyl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide

Drug info:

PubChemData

Smile

CCCCCOC1=C(C=C(C=N1)N)Br

DOS

IR

Vibrations