Crystallography Open Database

Information card for entry 7217028

Preview

Coordinates	7217028.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	4
Formula	C40 H48 N12 Ni2 O15
Calculated formula	C40 H48 N12 Ni2 O15
Title of publication	Self-assembly and magnetic properties of Ni(ii)/Co(ii) coordination polymers based on 1,4-bis(imidazol-1-yl)benzene and varying biphenyltetracarboxylates
Authors of publication	Su, Feng; Lu, Liping; Feng, Sisi; Zhu, Miaoli
Journal of publication	CrystEngComm
Year of publication	2014
Journal volume	16
Journal issue	34
Pages of publication	7990
a	24.343 ± 0.009 Å
b	12.291 ± 0.004 Å
c	18.868 ± 0.008 Å
α	90°
β	121.369 ± 0.01°
γ	90°
Cell volume	4820 ± 3 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.1017
Residual factor for significantly intense reflections	0.0583
Weighted residual factors for significantly intense reflections	0.1464
Weighted residual factors for all reflections included in the refinement	0.1743
Goodness-of-fit parameter for all reflections included in the refinement	1.028
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
180501 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/70.	7217028.cif
121603	2014-08-08	cif/ Updating files of 7217025, 7217026, 7217027, 7217028, 7217029 Original log message: Adding full bibliography for 7217025--7217029.cif.	7217028.cif
119005	2014-07-05	cif/ Adding structures of 7217025, 7217026, 7217027, 7217028, 7217029 via cif-deposit CGI script.	7217028.cif