Crystallography Open Database

Information card for entry 4102700

Preview

Coordinates	4102700.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C27 H31 Cl F5 N3 Si
Calculated formula	C27 H31 Cl F5 N3 Si
Title of publication	Selective Aromatic C-F and C-H Bond Activation with Silylenes of Different Coordinate Silicon
Authors of publication	Anukul Jana; Prinson P. Samuel; Gašper Tavčar; Herbert W. Roesky; Carola Schulzke
Journal of publication	Journal of the American Chemical Society
Year of publication	2010
Journal volume	132
Pages of publication	10164 - 10170
a	9.832 ± 0.002 Å
b	10.142 ± 0.002 Å
c	14.53 ± 0.003 Å
α	88.37 ± 0.03°
β	88.69 ± 0.03°
γ	71.03 ± 0.03°
Cell volume	1369.5 ± 0.5 Å³
Cell temperature	133 ± 2 K
Ambient diffraction temperature	133 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0803
Residual factor for significantly intense reflections	0.055
Weighted residual factors for significantly intense reflections	0.1416
Weighted residual factors for all reflections included in the refinement	0.1493
Goodness-of-fit parameter for all reflections included in the refinement	1.065
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
178773 (current)	2016-03-21	cif/4/10/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/10/27.	4102700.cif
120076	2014-07-11	Adding DOIs to range 4/10 structures.	4102700.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4102700.cif
25602	2011-09-12	../uploads/cif-deposit/cod/cif Adding structures of 4102700 via cif-deposit CGI script.	4102700.cif