Geometry & MOs

Info

ID:	356802
PubChem CID:	127292342
Reduced:	ON6C17H28 (1)
Stoich.:	AB6C17D28 (1)
Weight, g/mol:	283.189592
ΔH_f, kcal/mol:	-12.25
Dipole, Da:	3.59
IP(EA), eV:	-8.47(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,4-dioxan-2-ylmethyl)-3-(1-prop-2-enylpiperidin-4-yl)urea

Drug info:

PubChemData

Smile

CCN1CCN(CC1)C2CCN(C2)C(=O)NCC3=NC(=NC=C3)C

DOS

IR

Vibrations