Crystallography Open Database

Information card for entry 7037361

Preview

Coordinates	7037361.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C59.8 H91.6 Mg N3 Na O4.7 Si
Calculated formula	C59.8 H91.6 Mg N3 Na O4.7 Si
Title of publication	Assessing the reactivity of sodium alkyl-magnesiates towards quinoxaline: single electron transfer (SET) vs. nucleophilic alkylation processes.
Authors of publication	Livingstone, Zoe; Hernán-Gómez, Alberto; Baillie, Sharon E.; Armstrong, David R.; Carrella, Luca M.; Clegg, William; Harrington, Ross W.; Kennedy, Alan R.; Rentschler, Eva; Hevia, Eva
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2016
Journal volume	45
Journal issue	14
Pages of publication	6175 - 6182
a	24.4651 ± 0.0011 Å
b	10.8289 ± 0.0004 Å
c	22.8846 ± 0.001 Å
α	90°
β	90°
γ	90°
Cell volume	6062.8 ± 0.4 Å³
Cell temperature	123 ± 2 K
Ambient diffraction temperature	123 ± 2 K
Number of distinct elements	7
Space group number	33
Hermann-Mauguin space group symbol	P n a 21
Hall space group symbol	P 2c -2n
Residual factor for all reflections	0.0922
Residual factor for significantly intense reflections	0.067
Weighted residual factors for significantly intense reflections	0.1502
Weighted residual factors for all reflections included in the refinement	0.1677
Goodness-of-fit parameter for all reflections included in the refinement	1.033
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
181732 (current)	2016-04-05	cif/ Updating files of 7037359, 7037360, 7037361, 7037362 Original log message: Adding full bibliography for 7037359--7037362.cif.	7037361.cif
170438	2015-11-21	cif/ Adding structures of 7037359, 7037360, 7037361, 7037362 via cif-deposit CGI script.	7037361.cif