Crystallography Open Database

Information card for entry 8105249

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Coordinates	8105249.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H26 Cl N2 P Pd
Calculated formula	C30 H26 Cl N2 P Pd
Title of publication	Crystal structure of chlorido (2-(4-ethylphenyl)pyrimidine-k2 C,N)(triphenylphosphane-kP) palladium(II), C30H26ClN2PPd
Authors of publication	Liu, Hui; Lou, Xin-Hua
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2020
Journal volume	235
Journal issue	3
Pages of publication	659 - 661
a	9.1278 ± 0.0005 Å
b	9.5892 ± 0.0007 Å
c	15.5255 ± 0.001 Å
α	79.827 ± 0.006°
β	89.131 ± 0.005°
γ	78.358 ± 0.005°
Cell volume	1309.74 ± 0.15 Å³
Cell temperature	291 ± 2 K
Ambient diffraction temperature	291.15 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	0.0447
Residual factor for significantly intense reflections	0.0342
Weighted residual factors for significantly intense reflections	0.0651
Weighted residual factors for all reflections included in the refinement	0.0706
Goodness-of-fit parameter for all reflections included in the refinement	1.056
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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