Geometry & MOs

Info

ID:	389270
PubChem CID:	134991958
Reduced:	VCl2O2C3H8 (1)
Stoich.:	AB2C2D3E8 (1)
Weight, g/mol:	242.05205
ΔH_f, kcal/mol:	-165.6
Dipole, Da:	6.22
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.762159
Charge, e:	0

Chem-info

IUPAC name:

magnesium;1,1,3,3-tetramethylcyclohexane;bromide

Drug info:

PubChemData

Smile

C=CCO.O=[V].Cl.Cl

DOS

IR

Vibrations