Crystallography Open Database





Information card for 7052626

7052625 << 7052626 >> 7052627

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Coordinates

7052626.cif

Structure parameters

Common name 1,5-Diphenylamino-8-ethylamino-tri-s-triazine
Chemical name 1,5-Diphenylamino-8-ethylamino-tri-s-triazine
Formula - C34 H34 N10 O2 -
Calculated formula - C34 H34 N10 O2 -
Title of publication A series of aryl-/alkyl-substituted melems
Authors of publication Schwarzer, Anke; Kroke, Edwin
Journal of publication New Journal of Chemistry
Year of publication 2011
Journal volume 35
Journal issue 4
Pages of publication 953
a 12.5928 ± 0.0007 Å
b 12.5928 ± 0.0007 Å
c 19.4047 ± 0.0019 Å
α 90°
β 90°
γ 90°
Cell volume 3077.2 ± 0.4 Å3
Cell temperature 100 ± 2 K
Ambient diffraction temperature 100 ± 2 K
Number of distinct elements 4
Hermann-Mauguin symmetry space group P 43 21 2
Hall symmetry space group P 4nw 2abw
Residual factor for all reflections 0.2683
Residual factor for observed reflections 0.0569
Weighted residual factors for the observed reflections 0.1159
Weighted residual factors for all reflections included in the refinement 0.1544
Goodness-of-fit parameter for observed reflections 0.808
Diffraction radiation wavelength 0.71073 Å
Diffraction radiation type MoKα
Has coordinates Yes
Has disorder Yes
Has Fobs No

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