Crystallography Open Database

Information card for entry 7709690

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Coordinates	7709690.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	H41 N52 O26.5 Pb6
Calculated formula	H40.9992 N52.001 O26.5 Pb6
Title of publication	Pentazolate coordination polymers self-assembled by in situ generated [Pb4(OH)4]4+ cubic cations trapping cyclo-N5−
Authors of publication	Yuan, Yuan; Xu, Yuangang; Xie, Qiang; Li, Dongxue; Lin, Qiuhan; Wang, Pengcheng; Lu, Ming
Journal of publication	Dalton Transactions
Year of publication	2022
a	14.9624 ± 0.0005 Å
b	14.9624 ± 0.0005 Å
c	7.3194 ± 0.0002 Å
α	90°
β	90°
γ	120°
Cell volume	1419.09 ± 0.08 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	4
Space group number	176
Hermann-Mauguin space group symbol	P 63/m
Hall space group symbol	-P 6c
Residual factor for all reflections	0.0271
Residual factor for significantly intense reflections	0.0206
Weighted residual factors for significantly intense reflections	0.0392
Weighted residual factors for all reflections included in the refinement	0.0409
Goodness-of-fit parameter for all reflections included in the refinement	1.046
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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