Crystallography Open Database

Information card for entry 4512132

Preview

Coordinates	4512132.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C26 H28 Co N4 O5
Calculated formula	C26 H28 Co N4 O5
Title of publication	Exploiting the Pyrazole-Carboxylate Mixed Ligand System in the Crystal Engineering of Coordination Polymers
Authors of publication	Hawes, Chris S.; Moubaraki, Boujemaa; Murray, Keith S.; Kruger, Paul E.; Turner, David R.; Batten, Stuart R.
Journal of publication	Crystal Growth & Design
Year of publication	2014
Journal volume	14
Journal issue	11
Pages of publication	5749
a	33.0036 ± 0.0008 Å
b	8.55033 ± 0.00011 Å
c	21.3589 ± 0.0004 Å
α	90°
β	124.052 ± 0.003°
γ	90°
Cell volume	4993.8 ± 0.2 Å³
Cell temperature	120 ± 0.2 K
Ambient diffraction temperature	120 ± 0.2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0566
Residual factor for significantly intense reflections	0.0456
Weighted residual factors for significantly intense reflections	0.103
Weighted residual factors for all reflections included in the refinement	0.1106
Goodness-of-fit parameter for all reflections included in the refinement	1.078
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179668 (current)	2016-03-24	cif/4/51/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/51/21.	4512132.cif
126844	2014-11-11	cif/ Updating files of 4512129, 4512130, 4512131, 4512132, 4512133, 4512134, 4512135 Original log message: Adding full bibliography for 4512129--4512135.cif.	4512132.cif
125213	2014-10-10	cif/ Adding structures of 4512129, 4512130, 4512131, 4512132, 4512133, 4512134, 4512135 via cif-deposit CGI script.	4512132.cif