Crystallography Open Database

Information card for entry 4511549

Preview

Coordinates	4511549.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C26 H17 N2 Ni O5.5
Calculated formula	C26 H17 N2 Ni O5.5
Title of publication	Effect of the Size of Aromatic Chelate Ligands on the Frameworks of Metal Dicarboxylate Polymers: From Helical Chains to 2-D Networks
Authors of publication	Han, Zheng-Bo; Cheng, Xiao-Ning; Chen, Xiao-Ming
Journal of publication	Crystal Growth & Design
Year of publication	2005
Journal volume	5
Journal issue	2
Pages of publication	695
a	7.6777 ± 0.0008 Å
b	19.0226 ± 0.0019 Å
c	15.2344 ± 0.0015 Å
α	90°
β	97.407 ± 0.002°
γ	90°
Cell volume	2206.4 ± 0.4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0786
Residual factor for significantly intense reflections	0.0592
Weighted residual factors for significantly intense reflections	0.1274
Weighted residual factors for all reflections included in the refinement	0.136
Goodness-of-fit parameter for all reflections included in the refinement	1.096
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
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4511549.cif
119734	2014-07-08	cif/ Adding structures of 4511548, 4511549, 4511550, 4511551 via cif-deposit CGI script.	4511549.cif