Crystallography Open Database

Information card for entry 2227715

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Structure parameters

Common name	4-Bromoanilinium perchlorate 18-crown-6 clathrate
Chemical name	4-Bromoanilinium perchlorate‒18-crown-6 (1/1)
Formula	C18 H31 Br Cl N O10
Calculated formula	C18 H31 Br Cl N O10
Title of publication	4-Bromoanilinium perchlorate 18-crown-6 clathrate
Authors of publication	Guo, Min; Zhao, Min Min
Journal of publication	Acta Crystallographica Section E
Year of publication	2010
Journal volume	66
Journal issue	11
Pages of publication	o2836
a	15.583 ± 0.007 Å
b	11.469 ± 0.005 Å
c	12.633 ± 0.006 Å
α	90°
β	90°
γ	90°
Cell volume	2257.8 ± 1.8 Å³
Cell temperature	93 ± 2 K
Ambient diffraction temperature	93 ± 2 K
Number of distinct elements	6
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Residual factor for all reflections	0.0406
Residual factor for significantly intense reflections	0.0377
Weighted residual factors for significantly intense reflections	0.1017
Weighted residual factors for all reflections included in the refinement	0.1039
Goodness-of-fit parameter for all reflections included in the refinement	1.011
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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