Crystallography Open Database

Information card for entry 7705164

Preview

Coordinates	7705164.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C27 H59 Cl Fe N4 Si5
Calculated formula	C27 H59 Cl Fe N4 Si5
SMILES	[Fe]([Si]1(Cl)[N](=C(N1C(C)(C)C)c1ccccc1)C(C)(C)C)(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C
Title of publication	Aminolysis of bis[bis(trimethylsilyl)amido]-manganese, -iron, and -cobalt for the synthesis of mono- and bis-silylene complexes.
Authors of publication	He, Zhiyuan; Xue, Xiaolian; Liu, Yilan; Yu, Na; Krogman, Jeremy P.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	36
Pages of publication	12586 - 12591
a	26.9482 ± 0.0014 Å
b	16.5518 ± 0.0008 Å
c	8.8695 ± 0.0004 Å
α	90°
β	90°
γ	90°
Cell volume	3956.2 ± 0.3 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	149.96 K
Number of distinct elements	6
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	0.0519
Residual factor for significantly intense reflections	0.0431
Weighted residual factors for significantly intense reflections	0.1163
Weighted residual factors for all reflections included in the refinement	0.122
Goodness-of-fit parameter for all reflections included in the refinement	1.056
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
257536 (current)	2020-10-06	cif/ Updating files of 7705159, 7705160, 7705161, 7705162, 7705163, 7705164, 7705165, 7705166, 7705167, 7705168 Original log message: Adding full bibliography for 7705159--7705168.cif.	7705164.cif
255334	2020-08-15	cif/ Adding structures of 7705159, 7705160, 7705161, 7705162, 7705163, 7705164, 7705165, 7705166, 7705167, 7705168 via cif-deposit CGI script.	7705164.cif