Crystallography Open Database

Information card for entry 7055182

Preview

Coordinates	7055182.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C52 H36 Mn2 N8 O8
Calculated formula	C52 H36 Mn2 N8 O8
Title of publication	Two-dimensional coordination polymers and metal‒organic gels of symmetrical and unsymmetrical dipyridyl β-diketones: luminescence, dye absorption and mechanical properties
Authors of publication	Banerjee, Kaustuv; Biradha, Kumar
Journal of publication	New J. Chem.
Year of publication	2016
Journal volume	40
Journal issue	3
Pages of publication	1997
a	10.614 ± 0.009 Å
b	8.737 ± 0.007 Å
c	12.75 ± 0.011 Å
α	90°
β	112.7 ± 0.02°
γ	90°
Cell volume	1090.8 ± 1.6 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/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.1163
Residual factor for significantly intense reflections	0.0483
Weighted residual factors for significantly intense reflections	0.1164
Weighted residual factors for all reflections included in the refinement	0.1416
Goodness-of-fit parameter for all reflections included in the refinement	0.793
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
181753 (current)	2016-04-05	cif/ Updating files of 7055182, 7055183, 7055184, 7055185, 7055186 Original log message: Adding full bibliography for 7055182--7055186.cif.	7055182.cif
170534	2015-11-25	cif/ Adding structures of 7055182, 7055183, 7055184, 7055185, 7055186 via cif-deposit CGI script.	7055182.cif