Crystallography Open Database

Information card for entry 4333988

Preview

Coordinates	4333988.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H27 Co Si
Calculated formula	C20 H27 Co Si
SMILES	[Co]1234567([c]8([Si](C)(C)C)[cH]1[cH]2[c]13[c]48cccc1)[CH]1=[CH]5CC[CH]6=[CH]7CC1
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	6.725 ± 0.003 Å
b	17.608 ± 0.008 Å
c	29.805 ± 0.013 Å
α	90°
β	90°
γ	90°
Cell volume	3529 ± 3 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	4
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0585
Residual factor for significantly intense reflections	0.0378
Weighted residual factors for significantly intense reflections	0.0885
Weighted residual factors for all reflections included in the refinement	0.0988
Goodness-of-fit parameter for all reflections included in the refinement	1.031
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.	4333988.cif
99797	2014-02-03	cif/ Adding structures of 4333988 via cif-deposit CGI script.	4333988.cif