Geometry & MOs

Info

ID:	418695
PubChem CID:	135106576
Reduced:	O3N4C19H22 (1)
Stoich.:	A3B4C19D22 (1)
Weight, g/mol:	350.236956
ΔH_f, kcal/mol:	-62.05
Dipole, Da:	6.64
IP(EA), eV:	-9.33(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-fluorophenyl)methyl-methylamino]-1-[3-(hydroxymethyl)-3-(2-methylpropyl)piperidin-1-yl]ethanone

Drug info:

PubChemData

Smile

C1CN(CCC1C2=CC=CC=C2)C(=O)C3=NN4CC(CNC(=O)C4=C3)O

DOS

IR

Vibrations