Geometry & MOs

Info

ID:	347299
PubChem CID:	127272093
Reduced:	ON4C17H28 (1)
Stoich.:	AB4C17D28 (1)
Weight, g/mol:	393.299142
ΔH_f, kcal/mol:	-32.78
Dipole, Da:	6.02
IP(EA), eV:	-8.69(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[4-[(2,6-dimethylmorpholin-4-yl)methyl]piperidine-1-carbonyl]piperidin-1-yl]butan-1-one

Drug info:

PubChemData

Smile

CN1CCCC1CNC(=O)C2=CN(N=C2C3CCCCC3)C

DOS

IR

Vibrations