Geometry & MOs

Info

ID:	144816
PubChem CID:	53417431
Reduced:	N2O2F3H7C8 (1)
Stoich.:	A2B2C3D7E8 (1)
Weight, g/mol:	204.126263
ΔH_f, kcal/mol:	-210.88
Dipole, Da:	5.35
IP(EA), eV:	-9.47(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-(aminomethyl)phenyl]piperidin-2-one

Drug info:

PubChemData

Smile

COC(=O)C1=C(C=CC(=N1)C(F)(F)F)N

DOS

IR

Vibrations