Crystallography Open Database

Information card for entry 7041966

7041965 << 7041966 >> 7041967

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Coordinates	7041966.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C102 H108 N10 O20 Zn2
Calculated formula	C92 H86 N8 O18 Zn2
Title of publication	Metal-organic frameworks utilising an interlocked, hexadentate linker containing a tetra-carboxylate axle and a bis(pyridine) wheel.
Authors of publication	Gholami, Ghazale; Baggi, Giorgio; Zhu, Kelong; Loeb, Stephen J.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2017
Journal volume	46
Journal issue	8
Pages of publication	2462 - 2470
a	11.4221 ± 0.0004 Å
b	21.2742 ± 0.0008 Å
c	19.0647 ± 0.0007 Å
α	90°
β	95.4192 ± 0.0019°
γ	90°
Cell volume	4611.9 ± 0.3 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 K
Number of distinct elements	5
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	0.0889
Residual factor for significantly intense reflections	0.0683
Weighted residual factors for significantly intense reflections	0.1795
Weighted residual factors for all reflections included in the refinement	0.1957
Goodness-of-fit parameter for all reflections included in the refinement	1.059
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
193785 (current)	2017-03-05	cif/ Updating files of 7041965, 7041966, 7041967, 7041968 Original log message: Adding full bibliography for 7041965--7041968.cif.	7041966.cif
191906	2017-02-08	cif/ Adding structures of 7041965, 7041966, 7041967, 7041968 via cif-deposit CGI script.	7041966.cif