Crystallography Open Database

Information card for entry 7207140

7207139 << 7207140 >> 7207141

Preview

Coordinates	7207140.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C33 H35 N3 O10.5 Zn2
Calculated formula	C24 H12 O7.5 Zn2
Title of publication	The synthesis, structures and reactions of zinc and cobalt metal‒organic frameworks incorporating an alkyne-based dicarboxylate linker
Authors of publication	Burrows, Andrew D.; Fisher, Laura C.; Hodgson, David; Mahon, Mary F.; Cessford, Naomi F.; Düren, Tina; Richardson, Christopher; Rigby, Sean P.
Journal of publication	CrystEngComm
Year of publication	2012
Journal volume	14
Journal issue	1
Pages of publication	188
a	19.807 ± 0.0003 Å
b	27.714 ± 0.0005 Å
c	27.847 ± 0.0005 Å
α	90°
β	90°
γ	90°
Cell volume	15286.1 ± 0.5 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	5
Space group number	58
Hermann-Mauguin space group symbol	P n m n
Hall space group symbol	-P 2n 2n
Residual factor for all reflections	0.1209
Residual factor for significantly intense reflections	0.0602
Weighted residual factors for significantly intense reflections	0.1523
Weighted residual factors for all reflections included in the refinement	0.1769
Goodness-of-fit parameter for all reflections included in the refinement	0.985
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176453 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7207140.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7207140.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7207140.cif
32488	2012-02-09	../uploads/cif-deposit/cod/cif Adding structures of 7207140, 7207141 via cif-deposit CGI script.	7207140.cif