Crystallography Open Database

Information card for entry 7063402

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Coordinates	7063402.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C41 H34 Cl N O0.5 P2 Pd S
Calculated formula	C41 H34 Cl N O0.5 P2 Pd S
Title of publication	Bimetallic Pd/Cu complexes of pyridylchalcogenolates and their catalytic activity in the Sonogashira reaction
Authors of publication	Pal, M. K.; Wadawale, A. P.; Dey, S.
Journal of publication	New Journal of Chemistry
Year of publication	2024
Journal volume	48
Journal issue	36
Pages of publication	15823 - 15829
a	10.9361 ± 0.0001 Å
b	16.7007 ± 0.0001 Å
c	40.8473 ± 0.0004 Å
α	90°
β	96.735 ± 0.001°
γ	90°
Cell volume	7408.89 ± 0.11 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	8
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0631
Residual factor for significantly intense reflections	0.0341
Weighted residual factors for significantly intense reflections	0.0928
Weighted residual factors for all reflections included in the refinement	0.1107
Goodness-of-fit parameter for all reflections included in the refinement	1.053
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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