Geometry & MOs

Info

ID:	412707
PubChem CID:	135085621
Reduced:	HgCl3H3C6 (1)
Stoich.:	AB3C3D6 (1)
Weight, g/mol:	170.13068
ΔH_f, kcal/mol:	71.77
Dipole, Da:	1.01
IP(EA), eV:	-8.65(-2.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(E)-6-methylhept-3-en-2-yl] acetate

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1[Hg]Cl)Cl)Cl

DOS

IR

Vibrations