Crystallography Open Database

Information card for entry 4104103

Preview

Coordinates	4104103.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C58 H82 Mg2 N4
Calculated formula	C58 H82 Mg2 N4
Title of publication	Experimental Electron Density Study of the Mg-Mg Bonding Character in a Magnesium(I) Dimer
Authors of publication	Jacob Overgaard; Cameron Jones; Andreas Stasch; Bo B. Iversen
Journal of publication	Journal of the American Chemical Society
Year of publication	2009
Journal volume	131
Pages of publication	4208 - 4209
a	14.4252 ± 0.0008 Å
b	14.2019 ± 0.0008 Å
c	26.7176 ± 0.0015 Å
α	90°
β	94.957 ± 0.003°
γ	90°
Cell volume	5453 ± 0.5 Å³
Cell temperature	89 ± 2 K
Ambient diffraction temperature	89 ± 2 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0475
Residual factor for significantly intense reflections	0.037
Weighted residual factors for all reflections included in the refinement	0.0678
Goodness-of-fit parameter for all reflections included in the refinement	1.476
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
178787 (current)	2016-03-21	cif/4/10/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/10/41.	4104103.cif
120076	2014-07-11	Adding DOIs to range 4/10 structures.	4104103.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4104103.cif
28611	2011-10-30	../uploads/cif-deposit/cod/cif Adding structures of 4104103 via cif-deposit CGI script.	4104103.cif