Crystal structures of (5<i>RS</i>)-(<i>Z</i>)-4-[5-(furan-2-yl)-3-phenyl-4,5-dihydro-1<i>H</i>-pyrazol-1-yl]-4-oxobut-2-enoic acid and (5<i>RS</i>)-(<i>Z</i>)-4-[5-(furan-2-yl)-3-(thiophen-2-yl)-4,5-dihydro-1<i>H</i>-pyrazol-1-yl]-4-oxobut-2-enoic acid
Authors of publication
Borisova, Kseniya K.; Toze, Flavien A. A.; Yagafarov, Nniyaz Z.; Zubkov, Fedor I.; Dorovatovskii, Pavel V.; Zubavichus, Yan V.; Khrustalev, Victor N.
Journal of publication
Acta Crystallographica Section E
Year of publication
2016
Journal volume
72
Journal issue
11
Pages of publication
1557 - 1561
a
7.294 ± 0.0015 Å
b
10.738 ± 0.002 Å
c
10.845 ± 0.002 Å
α
114.1 ± 0.03°
β
102.46 ± 0.03°
γ
97.57 ± 0.03°
Cell volume
733.7 ± 0.4 Å3
Cell temperature
100 ± 2 K
Ambient diffraction temperature
100 ± 2 K
Number of distinct elements
4
Space group number
2
Hermann-Mauguin space group symbol
P -1
Hall space group symbol
-P 1
Residual factor for all reflections
0.0916
Residual factor for significantly intense reflections
0.0754
Weighted residual factors for significantly intense reflections
0.1798
Weighted residual factors for all reflections included in the refinement
0.1989
Goodness-of-fit parameter for all reflections included in the refinement
