Crystallography Open Database

Information card for entry 7247730

Preview

Coordinates	7247730.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H48 Co2 N4 O16
Calculated formula	C48 H48 Co2 N4 O16
Title of publication	Solvent effect in the chemical design of coordination polymers of various topologies with Co2+ and Ni2+ ions and 2-furoate anions
Authors of publication	Uvarova, Marina A.; Lutsenko, Irina A.; Babeshkin, Konstantin A.; Sokolov, Andrey V.; Alexandrov, Eugeny V.; Efimov, Nikolay N.; Shmelev, Maxim A.; Khoroshilov, Andrey V.; Eremenko, Igor L.; Kiskin, Mikhail A.
Journal of publication	CrystEngComm
Year of publication	2023
Journal volume	25
Journal issue	48
Pages of publication	6786 - 6795
a	12.994 ± 0.003 Å
b	18.489 ± 0.004 Å
c	20.221 ± 0.004 Å
α	90°
β	90°
γ	90°
Cell volume	4858 ± 1.8 Å³
Cell temperature	150 K
Ambient diffraction temperature	150 K
Number of distinct elements	5
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.1222
Residual factor for significantly intense reflections	0.0675
Weighted residual factors for significantly intense reflections	0.1084
Weighted residual factors for all reflections included in the refinement	0.1274
Goodness-of-fit parameter for all reflections included in the refinement	1.008
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
288802 (current)	2024-01-06	cif/ Updating files of 7247730, 7247731, 7247732, 7247733 Original log message: Adding full bibliography for 7247730--7247733.cif.	7247730.cif
287626	2023-11-16	cif/ Adding structures of 7247730, 7247731, 7247732, 7247733 via cif-deposit CGI script.	7247730.cif