Crystallography Open Database

Information card for entry 2211610

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Structure parameters

Chemical name	Diisopropylethylammonium picrate
Formula	C14 H22 N4 O7
Calculated formula	C14 H22 N4 O7
Title of publication	Diisopropylethylammonium picrate
Authors of publication	Podoprygorina, Ganna; Böhmer, Volker; Bolte, Michael
Journal of publication	Acta Crystallographica Section E
Year of publication	2006
Journal volume	62
Journal issue	12
Pages of publication	o5903 - o5904
a	7.3769 ± 0.001 Å
b	11.3828 ± 0.0013 Å
c	20.715 ± 0.003 Å
α	90°
β	91.173 ± 0.011°
γ	90°
Cell volume	1739.1 ± 0.4 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0788
Residual factor for significantly intense reflections	0.0478
Weighted residual factors for significantly intense reflections	0.1096
Weighted residual factors for all reflections included in the refinement	0.1212
Goodness-of-fit parameter for all reflections included in the refinement	0.989
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	Yes

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