Geometry & MOs

Info

ID:	200810
PubChem CID:	79447315
Reduced:	BrCl2C13H17 (1)
Stoich.:	AB2C13D17 (1)
Weight, g/mol:	224.109856
ΔH_f, kcal/mol:	-24.5
Dipole, Da:	3.75
IP(EA), eV:	-9.64(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3-bis(chloromethyl)-2-methyloctane

Drug info:

PubChemData

Smile

CC(C)C(CC1=CC(=CC=C1)Br)(CCl)CCl

DOS

IR

Vibrations