Geometry & MOs

Info

ID:	305537
PubChem CID:	124958860
Reduced:	O2N4C19H30 (1)
Stoich.:	A2B4C19D30 (1)
Weight, g/mol:	488.224199
ΔH_f, kcal/mol:	-77.61
Dipole, Da:	5.0
IP(EA), eV:	-8.69(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3S)-3-[(4-chloro-3-methylphenoxy)methyl]-1-[(5-fluoro-2-methylphenyl)methyl]piperidin-3-yl]-1-morpholin-4-ylethanone

Drug info:

PubChemData

Smile

C1CCC2=C(C1)C(=NN2)C(=O)N3CCC[C@](CC3)(CN4CCCC4)O

DOS

IR

Vibrations