Crystallography Open Database

Information card for entry 7054461

Preview

Coordinates	7054461.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C6 H37 As2 Mn3 N9 Na9 O78.5 W18
Calculated formula	C6 H36.96 As2 Mn3 N9 Na9 O78.5 W18
Title of publication	Synthesis, crystal structure and properties of sandwich type compounds based on {AsW9} and a hexa-nuclear unit with three supporting TM‒triazole complexes
Authors of publication	Liu, Jia-min; Wang, Lu; Yu, Kai; Su, Zhan-hua; Wang, Chun-xiao; Wang, Chun-mei; Zhou, Bai-bin
Journal of publication	New J. Chem.
Year of publication	2015
Journal volume	39
Journal issue	2
Pages of publication	1139
a	13.9494 ± 0.0008 Å
b	13.9494 ± 0.0008 Å
c	33.76 ± 0.004 Å
α	90°
β	90°
γ	120°
Cell volume	5689.1 ± 0.8 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	8
Space group number	176
Hermann-Mauguin space group symbol	P 63/m
Hall space group symbol	-P 6c
Residual factor for all reflections	0.0682
Residual factor for significantly intense reflections	0.0433
Weighted residual factors for significantly intense reflections	0.1012
Weighted residual factors for all reflections included in the refinement	0.119
Goodness-of-fit parameter for all reflections included in the refinement	1.045
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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