Crystallography Open Database

Information card for entry 4324782

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Coordinates	4324782.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C27.94 H44 Cl N O4 Zr
Calculated formula	C27.94 H44 Cl N O4 Zr
Title of publication	Salen Complexes of Zirconium and Hafnium: Synthesis, Structural Characterization, Controlled Hydrolysis, and Solvent-Free Ring-Opening Polymerization of Cyclic Esters and Lactides
Authors of publication	Tanmoy Kumar Saha; Venkatachalam Ramkumar; Debashis Chakraborty
Journal of publication	Inorganic Chemistry
Year of publication	2011
Journal volume	50
Pages of publication	2720 - 2722
a	10.6139 ± 0.0008 Å
b	26.9865 ± 0.0019 Å
c	11.2087 ± 0.0008 Å
α	90°
β	99.814 ± 0.004°
γ	90°
Cell volume	3163.5 ± 0.4 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.1162
Residual factor for significantly intense reflections	0.0881
Weighted residual factors for significantly intense reflections	0.2212
Weighted residual factors for all reflections included in the refinement	0.2373
Goodness-of-fit parameter for all reflections included in the refinement	1.069
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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