Crystallography Open Database

Information card for entry 4302125

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Coordinates	4302125.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C35.5 H53 Mg N3
Calculated formula	C35.5 H53 Mg N3
Title of publication	β-Diketiminato Calcium and Magnesium Amides; Model Complexes for Hydroamination Catalysis
Authors of publication	Anthony G. M. Barrett; Ian J. Casely; Mark R. Crimmin; Michael S. Hill; Jennifer R. Lachs; Mary F. Mahon; Panayiotis A. Procopiou
Journal of publication	Inorganic Chemistry
Year of publication	2009
Journal volume	48
Pages of publication	4445 - 4453
a	19.1971 ± 0.0003 Å
b	21.1259 ± 0.0004 Å
c	17.7461 ± 0.0003 Å
α	90°
β	114.064 ± 0.001°
γ	90°
Cell volume	6571.5 ± 0.2 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	4
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.1147
Residual factor for significantly intense reflections	0.074
Weighted residual factors for significantly intense reflections	0.1984
Weighted residual factors for all reflections included in the refinement	0.2312
Goodness-of-fit parameter for all reflections included in the refinement	1.044
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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