Geometry & MOs

Info

ID:	361887
PubChem CID:	127304881
Reduced:	N3O3C17H25 (1)
Stoich.:	A3B3C17D25 (1)
Weight, g/mol:	298.189257
ΔH_f, kcal/mol:	-89.88
Dipole, Da:	5.51
IP(EA), eV:	-9.01(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,4-dioxan-2-yl-[2-(morpholin-4-ylmethyl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

C1CCN(C(C1)CN2CCOCC2)C(=O)COC3=CN=CC=C3

DOS

IR

Vibrations