Geometry & MOs

Info

ID:	248350
PubChem CID:	103080879
Reduced:	BrN2O3C14H23 (1)
Stoich.:	AB2C3D14E23 (1)
Weight, g/mol:	257.210327
ΔH_f, kcal/mol:	-98.69
Dipole, Da:	2.24
IP(EA), eV:	-8.63(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[2-[2-(dimethylamino)ethoxy]ethylamino]piperidin-1-yl]ethanone

Drug info:

PubChemData

Smile

CN(C)CCOCCNCC1=CC(=C(C(=C1)Br)O)OC

DOS

IR

Vibrations