Crystallography Open Database

Information card for entry 7703045

Preview

Coordinates	7703045.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H84 Ag2 Mo8 N6 O26
Calculated formula	C42 H84 Ag2 Mo8 N6 O26
Title of publication	[{AgL}<sub>2</sub>Mo<sub>8</sub>O<sub>26</sub>]<sup>n-</sup> complexes: a combined experimental and theoretical study.
Authors of publication	Chupina, Anastasia V.; Shayapov, Vladimir; Novikov, Alexander S.; Volchek, Victoria V.; Benassi, Enrico; Abramov, Pavel A.; Sokolov, Maxim N.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	5
Pages of publication	1522 - 1530
a	16.7622 ± 0.0008 Å
b	16.303 ± 0.0007 Å
c	23.535 ± 0.0009 Å
α	90°
β	90°
γ	90°
Cell volume	6431.5 ± 0.5 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0605
Residual factor for significantly intense reflections	0.0382
Weighted residual factors for significantly intense reflections	0.0824
Weighted residual factors for all reflections included in the refinement	0.0913
Goodness-of-fit parameter for all reflections included in the refinement	1.114
Diffraction radiation probe	x-ray
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
248942 (current)	2020-03-05	cif/ Updating files of 7703041, 7703042, 7703043, 7703044, 7703045, 7703046, 7703047, 7703048, 7703049, 7703050, 7703051 Original log message: Adding full bibliography for 7703041--7703051.cif.	7703045.cif
246215	2019-12-27	cif/ Adding structures of 7703041, 7703042, 7703043, 7703044, 7703045, 7703046, 7703047, 7703048, 7703049, 7703050, 7703051 via cif-deposit CGI script.	7703045.cif