Structural and Electronic Effects of 1,3,4-Thiadiazole Units Incorporated into Polythiophene Chains
Authors of publication
Pang, Hao; Skabara, Peter J.; Crouch, David J.; Duffy, Warren; Heeney, Martin; McCulloch, Iain; Coles, Simon J.; Horton, Peter N.; Hursthouse, Michael B.
Journal of publication
Macromolecules
Year of publication
2007
Journal volume
40
Journal issue
18
Pages of publication
6585
a
38.741 ± 0.004 Å
b
12.0548 ± 0.0014 Å
c
9.6188 ± 0.0011 Å
α
90°
β
90°
γ
90°
Cell volume
4492.1 ± 0.9 Å3
Cell temperature
120 ± 2 K
Ambient diffraction temperature
120 ± 2 K
Number of distinct elements
4
Space group number
60
Hermann-Mauguin space group symbol
P b c n
Hall space group symbol
-P 2n 2ab
Residual factor for all reflections
0.1155
Residual factor for significantly intense reflections
0.0633
Weighted residual factors for significantly intense reflections
0.1471
Weighted residual factors for all reflections included in the refinement
0.1965
Goodness-of-fit parameter for all reflections included in the refinement
