Crystallography Open Database

Information card for entry 7030504

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Coordinates	7030504.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C69 H77 Cl2 O4 P Ru
Calculated formula	C69 H77 Cl2 O4 P Ru
Title of publication	Calixarene-monophosphines as supramolecular chelators
Authors of publication	Sameni, Soheila; Lejeune, Manuel; Jeunesse, Catherine; Matt, Dominique; Welter, Richard
Journal of publication	Dalton Transactions
Year of publication	2009
Journal issue	38
Pages of publication	7912 - 7923
a	19.839 ± 0.001 Å
b	19.941 ± 0.001 Å
c	23.757 ± 0.001 Å
α	79.64 ± 0.05°
β	78.15 ± 0.05°
γ	82.04 ± 0.05°
Cell volume	8998 ± 2 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 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	0.1556
Residual factor for significantly intense reflections	0.0789
Weighted residual factors for significantly intense reflections	0.1764
Weighted residual factors for all reflections included in the refinement	0.2088
Goodness-of-fit parameter for all reflections included in the refinement	1.135
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Duplicate of	7002345
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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