Crystallography Open Database

Information card for entry 7059860

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Coordinates	7059860.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C57 H21 Au3 F36 N6
Calculated formula	C57 H21 Au3 F36 N6
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	8.3667 ± 0.0005 Å
b	31.7232 ± 0.0019 Å
c	25.7197 ± 0.0015 Å
α	90°
β	91.507 ± 0.002°
γ	90°
Cell volume	6824.1 ± 0.7 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0412
Residual factor for significantly intense reflections	0.0317
Weighted residual factors for significantly intense reflections	0.0664
Weighted residual factors for all reflections included in the refinement	0.0702
Goodness-of-fit parameter for all reflections included in the refinement	1.069
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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