Geometry & MOs

Info

ID:	398958
PubChem CID:	135036606
Reduced:	OH7C9 (1)
Stoich.:	AB7C9 (1)
Weight, g/mol:	212.250401
ΔH_f, kcal/mol:	18.99
Dipole, Da:	0.68
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.183508
Charge, e:	0

Chem-info

IUPAC name:

4,6,6,8-tetramethylundecane

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)/C=C/[C-]=O

DOS

IR

Vibrations