Five closely related 4-chloro-6,11-dihydro-5<i>H</i>-benzo[<i>b</i>]pyrimido[5,4-<i>f</i>]azepines: similar molecular structures but different supramolecular assemblies
Authors of publication
Acosta, Lina M.; Jurado, Jorge; Palma, Alirio; Cobo, Justo; Glidewell, Christopher
Journal of publication
Acta Crystallographica Section C
Year of publication
2015
Journal volume
71
Journal issue
12
a
8.657 ± 0.0005 Å
b
8.8622 ± 0.0017 Å
c
9.0321 ± 0.0011 Å
α
92.649 ± 0.013°
β
113.635 ± 0.009°
γ
100.632 ± 0.012°
Cell volume
618.34 ± 0.16 Å3
Cell temperature
120 ± 2 K
Ambient diffraction temperature
120 ± 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
0.0858
Residual factor for significantly intense reflections
0.0528
Weighted residual factors for significantly intense reflections
0.1163
Weighted residual factors for all reflections included in the refinement
0.1362
Goodness-of-fit parameter for all reflections included in the refinement