Crystallography Open Database

Information card for entry 7109995

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Coordinates	7109995.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C122.42 H102.84 Cl4.84 O18 Zn8
Calculated formula	C122.419 H102.837 Cl4.83733 O18 Zn8
Title of publication	Probing secondary coordination sphere influence on the oxygenation of zinc alkyls: formation of a unique zinc peroxide species
Authors of publication	Piotr Sobota; Rafal Petrus; Karolina Zelga; Lukasz Makolski; Dominik Kubicki; Janusz Lewinski
Journal of publication	Chem.Commun.
Year of publication	2013
Journal volume	49
Pages of publication	10477
a	17.903 ± 0.003 Å
b	22.986 ± 0.004 Å
c	39.788 ± 0.005 Å
α	91.26 ± 0.02°
β	91.15 ± 0.03°
γ	94.1 ± 0.03°
Cell volume	16324 ± 4 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 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	0.1402
Residual factor for significantly intense reflections	0.0635
Weighted residual factors for significantly intense reflections	0.1592
Weighted residual factors for all reflections included in the refinement	0.1858
Goodness-of-fit parameter for all reflections included in the refinement	1.031
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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