Geometry & MOs

Info

ID:	274187
PubChem CID:	103807615
Reduced:	OSBr2N2C13H18 (1)
Stoich.:	ABC2D2E13F18 (1)
Weight, g/mol:	258.194343
ΔH_f, kcal/mol:	-8.71
Dipole, Da:	3.61
IP(EA), eV:	-9.04(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(ethylaminomethyl)piperidin-1-yl]-2-(2-methoxyethoxy)ethanone

Drug info:

PubChemData

Smile

CCNCC1CCN(CC1)C(=O)C2=C(SC(=C2)Br)Br

DOS

IR

Vibrations