Crystallography Open Database

Information card for entry 1515028

Preview

Coordinates	1515028.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	2-THF
Formula	C38 H34 F6 Hg O1.5 P Sb
Calculated formula	C38 H34 F6 Hg O1.5 P Sb
Title of publication	Lewis acid enhancement by juxtaposition with an onium ion: the case of a mercury stibonium complex
Authors of publication	Lin, Tzu-Pin; Nelson, Ryan C.; Wu, Tianpin; Miller, Jeffrey T.; Gabbaï, François P.
Journal of publication	Chemical Science
Year of publication	2012
Journal volume	3
Journal issue	4
Pages of publication	1128
a	13.2206 ± 0.0015 Å
b	21.054 ± 0.002 Å
c	13.5998 ± 0.0015 Å
α	90°
β	118.154 ± 0.001°
γ	90°
Cell volume	3337.6 ± 0.6 Å³
Cell temperature	110 ± 2 K
Ambient diffraction temperature	110 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0231
Residual factor for significantly intense reflections	0.0212
Weighted residual factors for significantly intense reflections	0.0503
Weighted residual factors for all reflections included in the refinement	0.0512
Goodness-of-fit parameter for all reflections included in the refinement	1.008
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
176435 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries from ranges 1, 2.	1515028.cif
110843	2014-04-20	cif/ Adding structures of 1515025, 1515026, 1515027, 1515028 via cif-deposit CGI script.	1515028.cif