Geometry & MOs

Info

ID:	4988
PubChem CID:	12383
Reduced:	OCl2C6H12 (1)
Stoich.:	AB2C6D12 (1)
Weight, g/mol:	170.02652
ΔH_f, kcal/mol:	-83.65
Dipole, Da:	0.61
IP(EA), eV:	-10.01(0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-chloro-3-(3-chloropropoxy)propane

Drug info:

PubChemData

Smile

C(COCCCCl)CCl

DOS

IR

Vibrations