Geometry & MOs

Info

ID:	201505
PubChem CID:	79548410
Reduced:	ClN2O3C12H17 (1)
Stoich.:	AB2C3D12E17 (1)
Weight, g/mol:	244.215078
ΔH_f, kcal/mol:	-114.35
Dipole, Da:	3.3
IP(EA), eV:	-9.82(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-diethoxy-N-[(1-methylpiperidin-2-yl)methyl]ethanamine

Drug info:

PubChemData

Smile

CCOC(CNC(=O)C1=C(C=NC=C1)Cl)OCC

DOS

IR

Vibrations