Crystallography Open Database

Information card for entry 7206324

7206323 << 7206324 >> 7206325

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Coordinates	7206324.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C120 H108 N4 O40 Zn8
Calculated formula	C120 H76 N4 O38.445 Zn8
Title of publication	A single-crystalline microporous coordination polymer with mixed parallel and diagonal interpenetrating α-Po networks
Authors of publication	Han, Shuangbing; Ma, Zhenbo; Wei, Yanhu; Kravtsov, Victor Ch.; Luisi, Brian S.; Kulaots, Indrek; Moulton, Brian
Journal of publication	CrystEngComm
Year of publication	2011
Journal volume	13
Journal issue	15
Pages of publication	4838
a	29.536 ± 0.002 Å
b	29.536 ± 0.002 Å
c	41.76 ± 0.006 Å
α	90°
β	90°
γ	120°
Cell volume	31550 ± 5 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	151
Hermann-Mauguin space group symbol	P 31 1 2
Hall space group symbol	P 31 2 (0 0 4)
Residual factor for all reflections	0.1092
Residual factor for significantly intense reflections	0.0788
Weighted residual factors for significantly intense reflections	0.2074
Weighted residual factors for all reflections included in the refinement	0.2165
Goodness-of-fit parameter for all reflections included in the refinement	1.008
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
180394 (current)	2016-03-26	cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/63.	7206324.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7206324.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7206324.cif
23601	2011-08-09	../uploads/cif-deposit/cod/cif Adding structures of 7206324 via cif-deposit CGI script.	7206324.cif