Geometry & MOs

Info

ID:	344578
PubChem CID:	127268162
Reduced:	FON5C22H28 (1)
Stoich.:	ABC5D22E28 (1)
Weight, g/mol:	389.247855
ΔH_f, kcal/mol:	-30.42
Dipole, Da:	3.66
IP(EA), eV:	-8.78(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[(4-fluorophenyl)methyl]piperidin-1-yl]-N-(1-oxo-1-piperidin-1-ylpropan-2-yl)acetamide

Drug info:

PubChemData

Smile

C1CN(CCC1CC2=CC=C(C=C2)F)CC(=O)N3CCN(CC3)C4=NC=CN=C4

DOS

IR

Vibrations