Geometry & MOs

Info

ID:	200159
PubChem CID:	79355661
Reduced:	N3O3C12H23 (1)
Stoich.:	A3B3C12D23 (1)
Weight, g/mol:	254.124212
ΔH_f, kcal/mol:	-152.53
Dipole, Da:	5.18
IP(EA), eV:	-9.48(0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-4-methyl-1-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-2-one

Drug info:

PubChemData

Smile

CC1CC(=O)N(CC1N)CC(=O)NC(C)COC

DOS

IR

Vibrations