Crystallography Open Database

Information card for entry 4063932

Preview

Coordinates	4063932.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H64 Mg N8 O2 P2 Si2
Calculated formula	C30 H64 Mg N8 O2 P2 Si2
SMILES	[Mg](N([Si](C)(C)C)c1ccccc1)(N([Si](C)(C)C)c1ccccc1)([O]=P(N(C)C)(N(C)C)N(C)C)[O]=P(N(C)C)(N(C)C)N(C)C
Title of publication	Ligand and Coligand Effects on Ion Association in Magnesium Amides
Authors of publication	Torvisco, Ana; Ruhlandt-Senge, Karin
Journal of publication	Organometallics
Year of publication	2011
Journal volume	30
Journal issue	5
Pages of publication	986
a	13.8558 ± 0.0008 Å
b	16.678 ± 0.001 Å
c	18.8382 ± 0.0011 Å
α	90°
β	109.202 ± 0.001°
γ	90°
Cell volume	4111.1 ± 0.4 Å³
Cell temperature	99 ± 2 K
Ambient diffraction temperature	99 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0501
Residual factor for significantly intense reflections	0.0419
Weighted residual factors for significantly intense reflections	0.1236
Weighted residual factors for all reflections included in the refinement	0.1304
Goodness-of-fit parameter for all reflections included in the refinement	0.996
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
178534 (current)	2016-03-21	cif/4/06/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/06/39.	4063932.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4063932.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4063932.cif
32726	2012-02-10	../uploads/cif-deposit/cod/cif Adding structures of 4063932 via cif-deposit CGI script.	4063932.cif