Crystallography Open Database

Information card for entry 7024375

Preview

Coordinates	7024375.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H10 N2 Ni O6
Calculated formula	C12 H10 N2 Ni O6
Title of publication	Two-dimensional metal-organic frameworks with blue luminescence.
Authors of publication	Huh, Seong; Jung, Suhyun; Kim, Youngmee; Kim, Sung-Jin; Park, Seongsoon
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2010
Journal volume	39
Journal issue	5
Pages of publication	1261 - 1265
a	11.964 ± 0.0009 Å
b	8.2127 ± 0.0007 Å
c	12.5386 ± 0.0006 Å
α	90°
β	97.17 ± 0.004°
γ	90°
Cell volume	1222.37 ± 0.15 Å³
Cell temperature	150 ± 1 K
Ambient diffraction temperature	150 ± 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	0.112
Residual factor for significantly intense reflections	0.0516
Weighted residual factors for significantly intense reflections	0.1016
Weighted residual factors for all reflections included in the refinement	0.1266
Goodness-of-fit parameter for all reflections included in the refinement	1.029
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
179948 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/43.	7024375.cif
92455	2014-01-12	cif/ Adding structures of 7024373, 7024374, 7024375 via cif-deposit CGI script.	7024375.cif