Crystallography Open Database

Information card for entry 7035222

Preview

Coordinates	7035222.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H16 N4 O13 Zn2
Calculated formula	C12 H6 N4 O13 Zn2
Title of publication	Towards a better understanding of honeycomb alternating magnetic networks.
Authors of publication	Marino, Nadia; Armentano, Donatella; De Munno, Giovanni; Lloret, Francesc; Cano, Joan; Julve, Miguel
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2015
Journal volume	44
Journal issue	24
Pages of publication	11040 - 11051
a	9.5335 ± 0.001 Å
b	16.614 ± 0.002 Å
c	6.1915 ± 0.0006 Å
α	90°
β	101.659 ± 0.003°
γ	90°
Cell volume	960.44 ± 0.18 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	12
Hermann-Mauguin space group symbol	C 1 2/m 1
Hall space group symbol	-C 2y
Residual factor for all reflections	0.0357
Residual factor for significantly intense reflections	0.0307
Weighted residual factors for significantly intense reflections	0.0829
Weighted residual factors for all reflections included in the refinement	0.086
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
143586 (current)	2015-07-11	cif/ Updating files of 7035221, 7035222, 7035223 Original log message: Adding full bibliography for 7035221--7035223.cif.	7035222.cif
137178	2015-05-22	cif/ Adding structures of 7035221, 7035222, 7035223 via cif-deposit CGI script.	7035222.cif