Geometry & MOs

Info

ID:	157059
PubChem CID:	56413186
Reduced:	ON2C14H18 (2)
Stoich.:	AB2C14D18 (2)
Weight, g/mol:	483.253335
ΔH_f, kcal/mol:	-39.63
Dipole, Da:	6.43
IP(EA), eV:	-8.96(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[4-[(2,6-dimethylmorpholin-4-yl)methyl]piperidine-1-carbonyl]phenoxy]-N-(2-fluorophenyl)acetamide

Drug info:

PubChemData

Smile

CC1CN(CC(O1)C)CC2CCN(CC2)C(=O)CCC3=NC4=CC=CC=C4N3C5=CC=CC=C5

DOS

IR

Vibrations