Crystallography Open Database

Information card for entry 7250203

Preview

Coordinates	7250203.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H60 K6 Ni3 O42
Calculated formula	C30 H60 K6 Ni3 O42
Title of publication	The role of alkali metal cations in the construction of heterometallic NiII polymeric cyclopropane-1,1-dicarboxylates
Authors of publication	Zorina-Tikhonova, Ekaterina N.; Matiukhina, Anna K.; Korlyukov, Alexander A.; Goloveshkin, Alexander S.; Babeshkin, Konstantin A.; Efimov, Nikolay N.; Alexandrov, Eugeny V.; Kiskin, Mikhail A.; Eremenko, Igor L.
Journal of publication	CrystEngComm
Year of publication	2025
Journal volume	27
Journal issue	20
Pages of publication	3352 - 3361
a	10.2896 ± 0.0018 Å
b	12.302 ± 0.002 Å
c	12.719 ± 0.002 Å
α	75.425 ± 0.003°
β	66.665 ± 0.002°
γ	78.791 ± 0.003°
Cell volume	1422.6 ± 0.4 Å³
Cell temperature	184 ± 2 K
Ambient diffraction temperature	184.15 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0568
Residual factor for significantly intense reflections	0.0423
Weighted residual factors for significantly intense reflections	0.0948
Weighted residual factors for all reflections included in the refinement	0.1012
Goodness-of-fit parameter for all reflections included in the refinement	1.043
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
300716 (current)	2025-07-06	cif/ Updating files of 7250200, 7250201, 7250202, 7250203 Original log message: Adding full bibliography for 7250200--7250203.cif.	7250203.cif
298663	2025-04-01	cif/ Adding structures of 7250200, 7250201, 7250202, 7250203 via cif-deposit CGI script.	7250203.cif