Crystallography Open Database

Information card for entry 7112706

Preview

Coordinates	7112706.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C13 H23 In O2
Calculated formula	C13 H23 In O2
Title of publication	Tris(allyl) indium compounds: synthesis and structural characterization
Authors of publication	Peckermann, Ilja; Raabe, Gerhard; Spaniol, Thomas P.; Okuda, Jun
Journal of publication	Chemical Communications (Cambridge, United Kingdom)
Year of publication	2011
Journal volume	47
Journal issue	17
Pages of publication	5061 - 5063
a	14.325 ± 0.0011 Å
b	12.745 ± 0.0012 Å
c	15.7313 ± 0.0014 Å
α	90°
β	90°
γ	90°
Cell volume	2872.1 ± 0.4 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 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	0.0734
Residual factor for significantly intense reflections	0.0295
Weighted residual factors for significantly intense reflections	0.0574
Weighted residual factors for all reflections included in the refinement	0.0676
Goodness-of-fit parameter for all reflections included in the refinement	0.986
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Duplicate of	7106283
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
210838 (current)	2018-09-11	cif/7/ Updating bibliography in entries 7106283-7106285, 7112706-7112708. Marking entries 7112706-7112708 as duplicates of entries 7106283-7106285.	7112706.cif
180241	2016-03-26	cif/7/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/11/27.	7112706.cif
111798	2014-04-28	cif/ Adding structures of 7112706, 7112707, 7112708 via cif-deposit CGI script.	7112706.cif