Crystallography Open Database

Information card for entry 4120270

4120269 << 4120270 >> 4120271

Preview

Coordinates	4120270.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	(mu-NO2)Co(Medoen)Mg(Me3TACN)
Formula	C29 H57 Co Mg N8 O6.5
Calculated formula	C29.734 H50.984 Co Mg N8 O6
Title of publication	Selective Nitrite Reduction at Heterobimetallic CoMg Complexes
Authors of publication	Christopher Uyeda; Jonas C. Peters
Journal of publication	Journal of the American Chemical Society
Year of publication	2013
Journal volume	135
Pages of publication	12023 - 12031
a	22.7508 ± 0.0011 Å
b	13.7761 ± 0.0008 Å
c	22.5814 ± 0.0013 Å
α	90°
β	90°
γ	90°
Cell volume	7077.4 ± 0.7 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Residual factor for all reflections	0.1577
Residual factor for significantly intense reflections	0.0881
Weighted residual factors for significantly intense reflections	0.1968
Weighted residual factors for all reflections included in the refinement	0.2239
Goodness-of-fit parameter for all reflections included in the refinement	1.084
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
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4120270.cif
105930	2014-03-14	cif/ Adding structures of 4120270 via cif-deposit CGI script.	4120270.cif