Structure Data of Free Polyatomic Molecules
240
MW
C2H3Cl3
1,1,1-Trichloroethane
rs
C–C
Å
1.555(4)
Atom
C(1)
C(2)
as [Å]
0.2671
1.8225
C3v
Cl
Cl
Cl
CH3
When isotope effects: r(12C–35Cl) = r(13C–35Cl) + 0.0001Å and
r(12C–12C) = r(12C–13C) + 0.00008 Å, were taken into account, the
C–C distance was estimated to be 1.516 Å.
Sugie, M., Kato, M., Matsumura, C., Takeo, H.: J. Mol. Struct. 413-414 (1997) 487.
II/25B(3, 664)
Landolt-Börnstein
New Series II/28B