Crystallography Open Database

Information card for entry 7715117

Preview

Coordinates	7715117.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H28 Li2 N12 Nb Ni O2
Calculated formula	C18 H28 Li2 N12 Nb Ni O2
Title of publication	Switching of magnetic properties by topotactic reaction in a 1D CN-bridged Ni(II)-Nb(IV) system.
Authors of publication	Heczko, Michał; Nowicka, Beata
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2024
Journal volume	53
Journal issue	13
Pages of publication	5788 - 5795
a	12.2706 ± 0.0004 Å
b	14.4329 ± 0.0005 Å
c	14.611 ± 0.0005 Å
α	90°
β	94.782 ± 0.001°
γ	90°
Cell volume	2578.61 ± 0.15 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	7
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	0.0259
Residual factor for significantly intense reflections	0.023
Weighted residual factors for significantly intense reflections	0.0468
Weighted residual factors for all reflections included in the refinement	0.0476
Goodness-of-fit parameter for all reflections included in the refinement	1.149
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
290945 (current)	2024-04-05	cif/ Updating files of 7715116, 7715117 Original log message: Adding full bibliography for 7715116--7715117.cif.	7715117.cif
289757	2024-02-09	cif/ Adding structures of 7715116, 7715117 via cif-deposit CGI script.	7715117.cif