Crystallography Open Database

Information card for entry 4300952

Preview

Coordinates	4300952.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C66.5 H61 N3 O15.5 P5 Pr
Calculated formula	C66.5 H61 N3 O15.5 P5 Pr
Title of publication	From Parquets to Bricks: A Series of Lanthanide Coordination Polymers with Bis(diphenylphosphino)ethane Dioxide
Authors of publication	Zdenek Spichal; Marek Necas; Jiri Pinkas
Journal of publication	Inorganic Chemistry
Year of publication	2005
Journal volume	44
Pages of publication	2074 - 2080
a	12.1879 ± 0.0013 Å
b	12.5589 ± 0.0016 Å
c	23.158 ± 0.003 Å
α	77.291 ± 0.012°
β	88.717 ± 0.01°
γ	68.978 ± 0.011°
Cell volume	3221.5 ± 0.7 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 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	0.0777
Residual factor for significantly intense reflections	0.0471
Weighted residual factors for significantly intense reflections	0.0835
Weighted residual factors for all reflections included in the refinement	0.0927
Goodness-of-fit parameter for all reflections included in the refinement	0.949
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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