Crystallography Open Database

Information card for entry 7718857

Preview

Coordinates	7718857.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H68 Cu4 Mo8 N8 O30
Calculated formula	C48 H60 Cu4 Mo8 N8 O30
Title of publication	Crown ether-based hamburger POMOF combined with polypyrrole as a highly reversible lithium-ion battery anode material.
Authors of publication	Zhang, Hui; Ren, Zhujuan; Yu, Jiaying; Wang, Kuaibing; Mao, Feifei; Wu, Hua
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2025
Journal volume	54
Journal issue	26
Pages of publication	10280 - 10293
a	16.2005 ± 0.0002 Å
b	19.0929 ± 0.0004 Å
c	19.6816 ± 0.0003 Å
α	90°
β	95.706 ± 0.001°
γ	90°
Cell volume	6057.64 ± 0.17 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0718
Residual factor for significantly intense reflections	0.0342
Weighted residual factors for significantly intense reflections	0.0616
Weighted residual factors for all reflections included in the refinement	0.0654
Goodness-of-fit parameter for all reflections included in the refinement	0.791
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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