Crystallography Open Database

Information card for entry 7123887

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Coordinates	7123887.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C192 H302 Al4 N14 Na2 O9
Calculated formula	C192 H294 Al4 N14 Na2 O9
Title of publication	Reductive linear- and cyclo-trimerization of isocyanides using an Al‒Al-bonded compound
Authors of publication	Chen, Weixing; Zhao, Yanxia; Xu, Wenhua; Su, Ji-Hu; Shen, Lingyi; Liu, Li; Wu, Biao; Yang, Xiao-Juan
Journal of publication	Chemical Communications
Year of publication	2019
a	26.81 ± 0.005 Å
b	26.916 ± 0.005 Å
c	28.097 ± 0.006 Å
α	90 ± 0.03°
β	111.31 ± 0.03°
γ	90 ± 0.03°
Cell volume	18889 ± 7 Å³
Cell temperature	153 ± 2 K
Ambient diffraction temperature	153 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.1686
Residual factor for significantly intense reflections	0.1013
Weighted residual factors for significantly intense reflections	0.2179
Weighted residual factors for all reflections included in the refinement	0.2531
Goodness-of-fit parameter for all reflections included in the refinement	1.177
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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