Crystallography Open Database

Information card for entry 7059858

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Coordinates	7059858.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C19 H8 F12 N2
Calculated formula	C19 H8 F12 N2
Title of publication	Coinage metal metallacycles involving a fluorinated 3,5-diarylpyrazolate
Authors of publication	Lakhi, Jaspreet S.; Patterson, Monika R.; Dias, H. V. Rasika
Journal of publication	New Journal of Chemistry
Year of publication	2020
Journal volume	44
Journal issue	35
Pages of publication	14814 - 14822
a	17.7048 ± 0.0006 Å
b	17.7048 ± 0.0006 Å
c	31.8231 ± 0.0011 Å
α	90°
β	90°
γ	120°
Cell volume	8638.8 ± 0.5 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	99.99 K
Number of distinct elements	4
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Residual factor for all reflections	0.0342
Residual factor for significantly intense reflections	0.0332
Weighted residual factors for significantly intense reflections	0.0889
Weighted residual factors for all reflections included in the refinement	0.09
Goodness-of-fit parameter for all reflections included in the refinement	1.041
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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