Crystallography Open Database

Information card for entry 1556361

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Coordinates	1556361.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Chisholm 1822
Formula	C44 H54 Mg N2 O
Calculated formula	C44 H54 Mg N2 O
Title of publication	Chemistry of magnesium alkyls supported by 1,5,9-trimesityldipyrromethene and 2-[(2,6-diisopropylphenyl)amino]-4-[(2,6-diisopropylphenyl)imino]pent-2-ene. A comparative study
Authors of publication	Chisholm, Malcolm H.; Choojun, Kittisak; Gallucci, Judith C.; Wambua, Pasco M.
Journal of publication	Chemical Science
Year of publication	2012
Journal volume	3
Journal issue	12
Pages of publication	3445
a	9.307 ± 0.0001 Å
b	11.3957 ± 0.0001 Å
c	19.4004 ± 0.0002 Å
α	87.957 ± 0.001°
β	81.71 ± 0.001°
γ	71.96 ± 0.001°
Cell volume	1935.92 ± 0.04 Å³
Cell temperature	180 ± 2 K
Ambient diffraction temperature	180 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0846
Residual factor for significantly intense reflections	0.0491
Weighted residual factors for significantly intense reflections	0.1284
Weighted residual factors for all reflections included in the refinement	0.147
Goodness-of-fit parameter for all reflections included in the refinement	1.038
Diffraction radiation probe	x-ray
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
244378 (current)	2019-11-28	cif/ Adding structures of 1556361, 1556362, 1556363, 1556364 via cif-deposit CGI script.	1556361.cif