Crystallography Open Database

Information card for entry 4303841

Preview

Coordinates	4303841.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C39 H35 N9 Ni2 O11
Calculated formula	C39 H35 N9 Ni2 O11
Title of publication	New 3D Coordination Polymers Constructed from Pillared Metal-Formate Kagomé Layers Exhibiting Spin Canting Only in the Nickel(II) Complex
Authors of publication	Zuo-Xi Li; Jiong-Peng Zhao; E. C. Sañudo; Hong Ma; Zhong-Da Pan; Yong-Fei Zeng; Xian-He Bu
Journal of publication	Inorganic Chemistry
Year of publication	2009
Journal volume	48
Pages of publication	11601 - 11607
a	17.98 ± 0.004 Å
b	11.711 ± 0.002 Å
c	19.921 ± 0.004 Å
α	90°
β	110.97 ± 0.03°
γ	90°
Cell volume	3916.8 ± 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	0.1606
Residual factor for significantly intense reflections	0.1238
Weighted residual factors for significantly intense reflections	0.2705
Weighted residual factors for all reflections included in the refinement	0.2921
Goodness-of-fit parameter for all reflections included in the refinement	1.185
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4303841.html