Geometry & MOs

Info

ID:	412729
PubChem CID:	135085643
Reduced:	BrZnO2C12H21 (1)
Stoich.:	ABC2D12E21 (1)
Weight, g/mol:	198.16198
ΔH_f, kcal/mol:	48.27
Dipole, Da:	3.37
IP(EA), eV:	-6.14(-3.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3E)-5-(methoxymethoxy)deca-1,3-diene

Drug info:

PubChemData

Smile

CCCCCC(/C=C/C=[CH-])OCOC.[Zn+]Br

DOS

IR

Vibrations