Crystallography Open Database

Information card for entry 7221699

Preview

Coordinates	7221699.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C46 H52 Co5 N8 O28 P2
Calculated formula	C46 H52 Co5 N8 O28 P2
Title of publication	Modulating the microporosity of cobalt phosphonates via positional isomerism of co-linkers
Authors of publication	Zheng, Tao; Cai, Zhong-Sheng; Nie, Wei-Xuan; Ren, Min; Bao, Song-Song; Zheng, Li-Min
Journal of publication	CrystEngComm
Year of publication	2015
Journal volume	17
Journal issue	46
Pages of publication	8926
a	9.247 ± 0.004 Å
b	9.97 ± 0.005 Å
c	15.025 ± 0.008 Å
α	100.151 ± 0.009°
β	91.372 ± 0.009°
γ	91.776 ± 0.009°
Cell volume	1362.2 ± 1.2 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0998
Residual factor for significantly intense reflections	0.0483
Weighted residual factors for significantly intense reflections	0.072
Weighted residual factors for all reflections included in the refinement	0.0802
Goodness-of-fit parameter for all reflections included in the refinement	1.002
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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