Geometry & MOs

Info

ID:	12260
PubChem CID:	133634
Reduced:	NCl2C9H17 (1)
Stoich.:	AB2C9D17 (1)
Weight, g/mol:	209.073805
ΔH_f, kcal/mol:	-46.75
Dipole, Da:	2.71
IP(EA), eV:	-9.12(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(chloromethyl)-1-(3-chloropropyl)piperidine

Drug info:

PubChemData

Smile

C1CCN(C(C1)CCl)CCCCl

DOS

IR

Vibrations