Crystallography Open Database

Information card for entry 2217498

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Structure parameters

Chemical name	2,6-Diazidotoluene
Formula	C7 H6 N6
Calculated formula	C7 H6 N6
Title of publication	2,6-Diazidotoluene
Authors of publication	Klapötke, Thomas M.; Krumm, Burkhard; Scherr, Matthias; Spieß, Gunnar
Journal of publication	Acta Crystallographica Section E
Year of publication	2008
Journal volume	64
Journal issue	2
Pages of publication	o348 - o348
a	12.298 ± 0.005 Å
b	25.896 ± 0.005 Å
c	5.085 ± 0.005 Å
α	90°
β	90°
γ	90°
Cell volume	1619.4 ± 1.8 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	3
Space group number	56
Hermann-Mauguin space group symbol	P c c n
Hall space group symbol	-P 2ab 2ac
Residual factor for all reflections	0.0416
Residual factor for significantly intense reflections	0.0299
Weighted residual factors for significantly intense reflections	0.0535
Weighted residual factors for all reflections included in the refinement	0.0613
Goodness-of-fit parameter for all reflections included in the refinement	0.936
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	Yes

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