Crystallography Open Database

Information card for entry 7060363

Preview

Coordinates	7060363.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H46 Cl10 Fe2 N2 O4 P2 Pd2 S2
Calculated formula	C48 H46 Cl10 Fe2 N2 O4 P2 Pd2 S2
Title of publication	Synthesis and coordination of a hybrid phosphinoferrocene sulfonamide ligand
Authors of publication	Varmužová, Věra; Horký, Filip; Štěpnička, Petr
Journal of publication	New Journal of Chemistry
Year of publication	2021
Journal volume	45
Journal issue	6
Pages of publication	3319 - 3327
a	10.8367 ± 0.0006 Å
b	11.5827 ± 0.0007 Å
c	11.5985 ± 0.0007 Å
α	84.816 ± 0.002°
β	75.91 ± 0.002°
γ	79.007 ± 0.002°
Cell volume	1384.64 ± 0.14 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	9
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0303
Residual factor for significantly intense reflections	0.0249
Weighted residual factors for significantly intense reflections	0.0548
Weighted residual factors for all reflections included in the refinement	0.0573
Goodness-of-fit parameter for all reflections included in the refinement	1.085
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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