Crystallography Open Database

Information card for entry 7049093

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Structure parameters

Formula	C42 H60 B Cl8 Mg N5 Si2
Calculated formula	C42 H60 B Cl8 Mg N5 Si2
Title of publication	Amidomagnesium cations.
Authors of publication	Banerjee, Sumanta; Ankur, ?; Andrews, Alex P.; Varghese, Babu; Venugopal, Ajay
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	21
Pages of publication	7313 - 7319
a	15.9642 ± 0.0006 Å
b	18.7235 ± 0.0008 Å
c	17.2584 ± 0.0007 Å
α	90°
β	99.574 ± 0.001°
γ	90°
Cell volume	5086.8 ± 0.4 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 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	0.0624
Residual factor for significantly intense reflections	0.0408
Weighted residual factors for significantly intense reflections	0.0931
Weighted residual factors for all reflections included in the refinement	0.106
Goodness-of-fit parameter for all reflections included in the refinement	1.029
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
301850 (current)	2025-08-21	Add cross-references to PubChem compounds in COD range 7/04/ Each referenced PubChem compound corresponds to the full crystal structure.	7049093.cif
224444	2019-11-08	cif/ Updating files of 7049090, 7049091, 7049092, 7049093, 7049094, 7049095, 7049096 Original log message: Adding full bibliography for 7049090--7049096.cif.	7049093.cif
213773	2019-02-22	cif/ Adding structures of 7049090, 7049091, 7049092, 7049093, 7049094, 7049095, 7049096 via cif-deposit CGI script.	7049093.cif