Crystallography Open Database

Information card for entry 7247731

Preview

Coordinates	7247731.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C34 H26 Co N4 O6
Calculated formula	C34 H26 Co N4 O6
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	10.3085 ± 0.0007 Å
b	16.7006 ± 0.0011 Å
c	18.9218 ± 0.0013 Å
α	90°
β	90°
γ	90°
Cell volume	3257.5 ± 0.4 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	5
Space group number	56
Hermann-Mauguin space group symbol	P c c n
Hall space group symbol	-P 2ab 2ac
Residual factor for all reflections	0.0979
Residual factor for significantly intense reflections	0.0768
Weighted residual factors for significantly intense reflections	0.1527
Weighted residual factors for all reflections included in the refinement	0.1631
Goodness-of-fit parameter for all reflections included in the refinement	1.176
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.	7247731.cif
287626	2023-11-16	cif/ Adding structures of 7247730, 7247731, 7247732, 7247733 via cif-deposit CGI script.	7247731.cif