Crystallography Open Database

Information card for entry 4343460

Preview

Coordinates	4343460.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C50.63 H28.7 Ag Al Cl0.15 F36 Mo2 N2 O8 P2
Calculated formula	C50.625 H28.7 Ag Al Cl0.15 F36 Mo2 N2 O8 P2
Title of publication	Novel Two- and Three-Dimensional Organometallic-Organic Hybrid Materials Based on Polyphosphorus Complexes.
Authors of publication	Attenberger, Bianca; Peresypkina, Eugenia V.; Scheer, Manfred
Journal of publication	Inorganic chemistry
Year of publication	2015
Journal volume	54
Journal issue	14
Pages of publication	7021 - 7029
a	19.4449 ± 0.0004 Å
b	25.5505 ± 0.0005 Å
c	29.8544 ± 0.0006 Å
α	65.535 ± 0.002°
β	72.902 ± 0.002°
γ	87.29 ± 0.002°
Cell volume	12856.7 ± 0.5 Å³
Cell temperature	123 ± 2 K
Ambient diffraction temperature	123 ± 2 K
Number of distinct elements	10
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0617
Residual factor for significantly intense reflections	0.0508
Weighted residual factors for significantly intense reflections	0.129
Weighted residual factors for all reflections included in the refinement	0.1403
Goodness-of-fit parameter for all reflections included in the refinement	1.021
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
176429 (current)	2016-02-13	cif/ (antanas@kurmis) Replacing _cod_chemical_formula_sum_orig tag with _cod_original_formula_sum tag in multiple entries since the replaced tag is deprecated according to the COD CIF dictionary.	4343460.cif
152820	2015-08-05	cif/ Updating files of 4343458, 4343459, 4343460 Original log message: Adding full bibliography for 4343458--4343460.cif.	4343460.cif
139769	2015-06-30	cif/ Adding structures of 4343460 via cif-deposit CGI script.	4343460.cif