Crystallography Open Database

Information card for entry 4333986

Preview

Coordinates	4333986.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C27 H41 Co Si2
Calculated formula	C27 H41 Co Si2
SMILES	[Co]123456789([c]%10([Si](C)(C)C)[cH]1[c]2([Si](C)(C)C)[c]13[c]4%10cccc1)[c]1([c]5([c]6([c]7([c]8([c]91C)C)C)C)C)C
Title of publication	Synthesis of a Bis(indenyl) Co(I) Anion: A Reactive Source of a 14 Electron Indenyl Co(I) Equivalent
Authors of publication	Fernando Hung-Low; Christopher A. Bradley
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	2446 - 2457
a	8.6849 ± 0.0008 Å
b	10.1831 ± 0.001 Å
c	15.6828 ± 0.0015 Å
α	80.997 ± 0.001°
β	84.276 ± 0.001°
γ	78.29 ± 0.001°
Cell volume	1338.1 ± 0.2 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0418
Residual factor for significantly intense reflections	0.0329
Weighted residual factors for significantly intense reflections	0.0818
Weighted residual factors for all reflections included in the refinement	0.0869
Goodness-of-fit parameter for all reflections included in the refinement	1.019
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
179442 (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 4/33/39.	4333986.cif
99795	2014-02-03	cif/ Adding structures of 4333986 via cif-deposit CGI script.	4333986.cif