Crystallography Open Database

Information card for entry 7234322

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Coordinates	7234322.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C21 H19 Cu F12 N4 O6
Calculated formula	C21 H19 Cu F12 N4 O6
Title of publication	A heterospin pressure sensor
Authors of publication	Kseniya Yu. Maryunina; Xiao Zhang; Sadafumi Nishihara; Katsuya Inoue; Vitaly A. Morozov; Galina V. Romanenko; Victor I. Ovcharenko
Journal of publication	Journal of Materials Chemistry C
Year of publication	2015
Journal volume	3
Pages of publication	7788 - 7791
a	12.3044 ± 0.0014 Å
b	16.188 ± 0.002 Å
c	15.6103 ± 0.0018 Å
α	90°
β	108.424 ± 0.007°
γ	90°
Cell volume	2949.9 ± 0.6 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.1482
Residual factor for significantly intense reflections	0.0463
Weighted residual factors for significantly intense reflections	0.0944
Weighted residual factors for all reflections included in the refinement	0.1176
Goodness-of-fit parameter for all reflections included in the refinement	0.792
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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