Crystallography Open Database

Information card for entry 7200189

7200188 << 7200189 >> 7200190

Preview

Coordinates	7200189.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H22 Cu N3 O6.5
Calculated formula	C20 H21 Cu N3 O6.5
Title of publication	Metal‒organic frameworks based on the pyridine-2,3-dicarboxylate and a flexible bispyridyl ligand: syntheses, structures, and photoluminescence
Authors of publication	Wang, Guan-Hua; Li, Zhi-Gang; Jia, Heng-Qing; Hu, Ning-Hai; Xu, Jing-Wei
Journal of publication	CrystEngComm
Year of publication	2009
Journal volume	11
Journal issue	2
Pages of publication	292
a	12.4745 ± 0.0004 Å
b	12.4745 ± 0.0004 Å
c	26.721 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	4158.1 ± 0.4 Å³
Cell temperature	185 ± 2 K
Ambient diffraction temperature	185 ± 2 K
Number of distinct elements	5
Space group number	96
Hermann-Mauguin space group symbol	P 43 21 2
Hall space group symbol	P 4nw 2abw
Residual factor for all reflections	0.0458
Residual factor for significantly intense reflections	0.0363
Weighted residual factors for significantly intense reflections	0.0899
Weighted residual factors for all reflections included in the refinement	0.0946
Goodness-of-fit parameter for all reflections included in the refinement	1.066
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7200189.html