Crystallography Open Database

Information card for entry 2206962

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Structure parameters

Common name	([1.5]Dibenzo-18-crown-6-κ^6^)potassium chlorochromate
Chemical name	(6,7,9,10,12,13,15,16- octahydrodibenzo[b,e][1,4,7,10,13,16] hexaoxacyclooctadecine)potassium chlorochromate
Formula	C20 H24 Cl Cr K O9
Calculated formula	C20 H24 Cl Cr K O9
Title of publication	([1.5]Dibenzo-18-crown-6)potassium chlorochromate
Authors of publication	Kotlyar, Sergei A.; Zubatyuk, Roman I.; Shishkin, Oleg V.; Chuprin, Gennady N.; Kiriyak, Andrey V.; Kamalov, Gerbert L.
Journal of publication	Acta Crystallographica Section E
Year of publication	2005
Journal volume	61
Journal issue	10
Pages of publication	m2163 - m2165
a	10.139 ± 0.003 Å
b	10.649 ± 0.004 Å
c	12.138 ± 0.003 Å
α	95.34 ± 0.03°
β	94.11 ± 0.02°
γ	113.05 ± 0.02°
Cell volume	1192.3 ± 0.7 Å³
Cell temperature	295 ± 2 K
Ambient diffraction temperature	295 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1141
Residual factor for significantly intense reflections	0.0676
Weighted residual factors for significantly intense reflections	0.1803
Weighted residual factors for all reflections included in the refinement	0.1969
Goodness-of-fit parameter for all reflections included in the refinement	1.043
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	Yes

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