Crystallography Open Database

Information card for entry 7238574

Preview

Coordinates	7238574.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H16 Ba N6 O20
Calculated formula	C12 H16 Ba N6 O20
Title of publication	Salts of 1-(chloromethyl)-1,1-dimethylhydrazine and ionic liquids
Authors of publication	Miró Sabaté, Carles; Delalu, Henri; Forquet, Valérian; Jeanneau, Erwann
Journal of publication	RSC Advances
Year of publication	2012
Journal volume	2
Journal issue	9
Pages of publication	3691
a	6.6417 ± 0.0005 Å
b	11.5885 ± 0.0008 Å
c	15.0331 ± 0.0009 Å
α	84.647 ± 0.005°
β	80.07 ± 0.006°
γ	86.803 ± 0.006°
Cell volume	1133.82 ± 0.14 Å³
Cell temperature	110 K
Ambient diffraction temperature	110 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0398
Residual factor for significantly intense reflections	0.0358
Weighted residual factors for all reflections	0.0773
Weighted residual factors for significantly intense reflections	0.0693
Weighted residual factors for all reflections included in the refinement	0.0773
Goodness-of-fit parameter for all reflections included in the refinement	0.9995
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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