Crystallography Open Database

Information card for entry 7049032

Preview

Coordinates	7049032.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H64 Co2 Li2 N2 O12
Calculated formula	C40 H64 Co2 Li2 N2 O12
Title of publication	Rational synthesis and dimensionality tuning of MOFs from preorganized heterometallic molecular complexes.
Authors of publication	Sapianik, Aleksandr A.; Kiskin, Mikhail A.; Kovalenko, Konstantin A.; Samsonenko, Denis G.; Dybtsev, Danil N.; Audebrand, Nathalie; Sun, Yaguang; Fedin, Vladimir P.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	11
Pages of publication	3676 - 3686
a	9.379 ± 0.003 Å
b	12.106 ± 0.005 Å
c	12.656 ± 0.005 Å
α	117.147 ± 0.01°
β	96.61 ± 0.01°
γ	89.912 ± 0.01°
Cell volume	1268.1 ± 0.8 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0944
Residual factor for significantly intense reflections	0.0718
Weighted residual factors for significantly intense reflections	0.191
Weighted residual factors for all reflections included in the refinement	0.2109
Goodness-of-fit parameter for all reflections included in the refinement	1.11
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
224534 (current)	2019-11-08	cif/ Updating files of 7049032, 7049033, 7049034, 7049035, 7049036 Original log message: Adding full bibliography for 7049032--7049036.cif.	7049032.cif
213675	2019-02-16	cif/ Adding structures of 7049032, 7049033, 7049034, 7049035, 7049036 via cif-deposit CGI script.	7049032.cif