Crystallography Open Database

Information card for entry 7046182

Preview

Coordinates	7046182.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H25 Cl2 Mo N3 O3 Si
Calculated formula	C28 H25 Cl2 Mo N3 O3 Si
Title of publication	The coordination chemistry of the neutral tris-2-pyridyl silicon ligand [PhSi(6-Me-2-py)<sub>3</sub>].
Authors of publication	Plajer, Alex J.; Colebatch, Annie L.; Enders, Markus; García-Romero, Álvaro; Bond, Andrew D.; García-Rodríguez, Raúl; Wright, Dominic S.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2018
Journal volume	47
Journal issue	20
Pages of publication	7036 - 7043
a	10.3558 ± 0.0003 Å
b	10.5909 ± 0.0003 Å
c	13.4578 ± 0.0004 Å
α	71.772 ± 0.001°
β	87.466 ± 0.001°
γ	77.47 ± 0.001°
Cell volume	1368.11 ± 0.07 Å³
Cell temperature	180 ± 2 K
Ambient diffraction temperature	180 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0378
Residual factor for significantly intense reflections	0.0335
Weighted residual factors for significantly intense reflections	0.0814
Weighted residual factors for all reflections included in the refinement	0.0834
Goodness-of-fit parameter for all reflections included in the refinement	1.103
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
229701 (current)	2019-11-17	cif/ Updating files of 7046180, 7046181, 7046182, 7046183, 7046184, 7046185 Original log message: Adding full bibliography for 7046180--7046185.cif.	7046182.cif
207595	2018-05-01	cif/ Adding structures of 7046180, 7046181, 7046182, 7046183, 7046184, 7046185 via cif-deposit CGI script.	7046182.cif