Crystallography Open Database

Information card for entry 4350149

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Coordinates	4350149.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H68 N2 O4 Zr
Calculated formula	C40 H68 N2 O4 Zr
Title of publication	Titanium and zirconium complexes of dianionic and trianionic amine-phenolate-type ligands in catalysis of lactide polymerization.
Authors of publication	Gendler, Shimrit; Segal, Sharon; Goldberg, Israel; Goldschmidt, Zeev; Kol, Moshe
Journal of publication	Inorganic chemistry
Year of publication	2006
Journal volume	45
Journal issue	12
Pages of publication	4783 - 4790
a	12.631 ± 0.0003 Å
b	19.625 ± 0.0006 Å
c	16.581 ± 0.0003 Å
α	90°
β	96.55 ± 0.0015°
γ	90°
Cell volume	4083.33 ± 0.17 Å³
Cell temperature	110 ± 2 K
Ambient diffraction temperature	110 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.1154
Residual factor for significantly intense reflections	0.0588
Weighted residual factors for significantly intense reflections	0.1414
Weighted residual factors for all reflections included in the refinement	0.1701
Goodness-of-fit parameter for all reflections included in the refinement	0.963
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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