Crystallography Open Database

Information card for entry 4074706

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Coordinates	4074706.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H57 Al Si2 Zr
Calculated formula	C32 H57 Al Si2 Zr
Title of publication	Simple Alumination Reactions of Pentamethylcyclopentadienyl Ligands in the Decamethylzirconocene−Bis(trimethylsilyl)acetylene Complex Cp*2Zr(η2-Me3SiC2SiMe3)
Authors of publication	Burlakov, Vladimir V.; Arndt, Perdita; Baumann, Wolfgang; Spannenberg, Anke; Rosenthal, Uwe
Journal of publication	Organometallics
Year of publication	2006
Journal volume	25
Journal issue	2
Pages of publication	519
a	10.036 ± 0.002 Å
b	11.342 ± 0.002 Å
c	16.376 ± 0.003 Å
α	88.48 ± 0.03°
β	73.14 ± 0.03°
γ	74.79 ± 0.03°
Cell volume	1719 ± 0.7 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1195
Residual factor for significantly intense reflections	0.0613
Weighted residual factors for significantly intense reflections	0.1334
Weighted residual factors for all reflections included in the refinement	0.1484
Goodness-of-fit parameter for all reflections included in the refinement	0.867
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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