Crystallography Open Database

Information card for entry 4336607

Preview

Coordinates	4336607.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C26 H46 Mg2 N6 O
Calculated formula	C26 H46 Mg2 N6 O
Title of publication	Heteroscorpionate Magnesium Alkyls Bearing Unprecedented Apical σ-C(sp3)-Mg Bonds: Heteroselective Ring-Opening Polymerization of rac-Lactide
Authors of publication	Andrés Garcés; Luis F. Sánchez-Barba; Juan Fernández-Baeza; Antonio Otero; Manuel Honrado; Agustín Lara-Sánchez; Ana M. Rodríguez
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	12691 - 12701
a	19.328 ± 0.008 Å
b	8.623 ± 0.004 Å
c	19.682 ± 0.007 Å
α	90°
β	109.98 ± 0.012°
γ	90°
Cell volume	3083 ± 2 Å³
Cell temperature	260 ± 2 K
Ambient diffraction temperature	260 ± 2 K
Number of distinct elements	5
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	0.118
Residual factor for significantly intense reflections	0.0724
Weighted residual factors for significantly intense reflections	0.227
Weighted residual factors for all reflections included in the refinement	0.2769
Goodness-of-fit parameter for all reflections included in the refinement	0.922
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
179469 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/66.	4336607.cif
102613	2014-02-21	cif/ Adding structures of 4336607 via cif-deposit CGI script.	4336607.cif