Crystallography Open Database

Information card for entry 1519700

1519699 << 1519700 >> 1519701

Preview

Coordinates	1519700.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30.5 H18 Co3 N8 O8.5
Calculated formula	C30.5 H18 Co3 N8 O8.5
Title of publication	A series of multidimensional MOFs incorporating a new N-heterocyclic building block: 5,5′-di(pyridin-4-yl)-3,3′-bi(1,2,4-triazole)
Authors of publication	Yao, Peng-Fei; Li, Hai-Ye; Huang, Fu-Ping; Yu, Qing; Qin, Xao-Huan; Tang, Jie; Tao, Ye; Bian, He-Dong
Journal of publication	RSC Advances
Year of publication	2015
Journal volume	5
Journal issue	60
Pages of publication	48596 - 48606
a	9.2529 ± 0.0012 Å
b	10.6355 ± 0.0011 Å
c	11.0493 ± 0.0013 Å
α	63.622 ± 0.011°
β	86.489 ± 0.01°
γ	74.907 ± 0.01°
Cell volume	938.7 ± 0.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0672
Residual factor for significantly intense reflections	0.0596
Weighted residual factors for significantly intense reflections	0.1872
Weighted residual factors for all reflections included in the refinement	0.1933
Goodness-of-fit parameter for all reflections included in the refinement	1.171
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
282777 (current)	2023-04-20	cod/ (saulius@starta) Updating COD bibliographies for 271 COD entries identified by R.M.	1519700.cif
176429	2016-02-13	cif/ (antanas@kurmis) Replacing _cod_chemical_formula_sum_orig tag with _cod_original_formula_sum tag in multiple entries since the replaced tag is deprecated according to the COD CIF dictionary.	1519700.cif
136907	2015-05-18	cif/ Adding structures of 1519699, 1519700, 1519701, 1519702, 1519703, 1519704 via cif-deposit CGI script.	1519700.cif