Crystallography Open Database

Information card for entry 7031422

Preview

Coordinates	7031422.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H56 Mg2 Mo6 N4 O28
Calculated formula	C20 H56 Mg2 Mo6 N4 O28
Title of publication	Retrosynthetic approach to the design of molybdenum-magnesium oxoalkoxides.
Authors of publication	Kuznetsov, Denis A.; Fedyanin, Ivan V.; Lyssenko, Konstantin A.; Bazhenova, Tamara A.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2014
Journal volume	43
Journal issue	34
Pages of publication	12876
a	39.69 ± 0.004 Å
b	39.69 ± 0.004 Å
c	9.2538 ± 0.0009 Å
α	90°
β	90°
γ	120°
Cell volume	12624 ± 2 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Residual factor for all reflections	0.0544
Residual factor for significantly intense reflections	0.0375
Weighted residual factors for significantly intense reflections	0.0954
Weighted residual factors for all reflections included in the refinement	0.1006
Goodness-of-fit parameter for all reflections included in the refinement	1.028
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
180020 (current)	2016-03-25	cif/7/03/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/03/14.	7031422.cif
121672	2014-08-08	cif/ Updating files of 7031417, 7031418, 7031419, 7031420, 7031421, 7031422 Original log message: Adding full bibliography for 7031417--7031422.cif.	7031422.cif
117981	2014-06-23	cif/ Adding structures of 7031417, 7031418, 7031419, 7031420, 7031421, 7031422 via cif-deposit CGI script.	7031422.cif