Crystallography Open Database

Information card for entry 7061942

7061941 << 7061942 >> 7061943

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Coordinates	7061942.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C39 H53 F6 O3 P Pd
Calculated formula	C39 H53 F6 O3 P Pd
Title of publication	Preparation, characterization and reactivity of trifluoromethoxy palladium(ii) complexes
Authors of publication	Xu, Songsong; Shao, Yingbo; Zheng, Hanliang; Leng, Xuebing; Xue, Xiao-Song; Shen, Qilong
Journal of publication	New Journal of Chemistry
Year of publication	2022
Journal volume	46
Journal issue	43
Pages of publication	20760 - 20767
a	12.1827 ± 0.0004 Å
b	12.7262 ± 0.0004 Å
c	13.4392 ± 0.0004 Å
α	87.361 ± 0.002°
β	71.886 ± 0.002°
γ	80.533 ± 0.002°
Cell volume	1953.34 ± 0.11 Å³
Cell temperature	170.05 K
Ambient diffraction temperature	170.05 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	0.0413
Residual factor for significantly intense reflections	0.0368
Weighted residual factors for significantly intense reflections	0.0911
Weighted residual factors for all reflections included in the refinement	0.0944
Goodness-of-fit parameter for all reflections included in the refinement	1.041
Diffraction radiation wavelength	1.34139 Å
Diffraction radiation type	GaKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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