Crystallography Open Database

Information card for entry 7106203

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Coordinates	7106203.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C94 H118 Cr2 Li6 N12 O8
Calculated formula	C94 H118 Cr2 Li6 N12 O8
Title of publication	A quadruply-bonded [Cr2(guanidinate)4]4? tetraanion
Authors of publication	Joanna Haywood; Francesca A. Stokes; Robert J. Less; Mary McPartlin; Andrew E. H. Wheatley; Dominic S. Wright
Journal of publication	Chem.Commun.
Year of publication	2011
Journal volume	47
Pages of publication	4120
a	13.3034 ± 0.0002 Å
b	26.0736 ± 0.0003 Å
c	13.4077 ± 0.0002 Å
α	90°
β	92.383 ± 0.001°
γ	90°
Cell volume	4646.67 ± 0.11 Å³
Cell temperature	180 ± 2 K
Ambient diffraction temperature	180 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0928
Residual factor for significantly intense reflections	0.0723
Weighted residual factors for significantly intense reflections	0.1571
Weighted residual factors for all reflections included in the refinement	0.1666
Goodness-of-fit parameter for all reflections included in the refinement	1.139
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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