Crystallography Open Database

Information card for entry 1515792

Preview

Coordinates	1515792.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10 H22.32 F2 N2 O97 Si48
Calculated formula	C10 H22.32 F2 N2 O97 Si48
Title of publication	Task specific ionic liquids for the ionothermal synthesis of siliceous zeolites
Authors of publication	Wheatley, Paul S.; Allan, Phoebe K.; Teat, Simon J.; Ashbrook, Sharon E.; Morris, Russell E.
Journal of publication	Chemical Science
Year of publication	2010
Journal volume	1
Journal issue	4
Pages of publication	483
a	19.959 ± 0.005 Å
b	19.89 ± 0.005 Å
c	13.407 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	5322 ± 2 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Residual factor for all reflections	0.1416
Residual factor for significantly intense reflections	0.0735
Weighted residual factors for significantly intense reflections	0.1857
Weighted residual factors for all reflections included in the refinement	0.2133
Goodness-of-fit parameter for all reflections included in the refinement	0.958
Diffraction radiation wavelength	0.7749 Å
Diffraction radiation type	synchrotron
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176729 (current)	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1.	1515792.cif
112256	2014-04-30	cif/ Adding structures of 1515792, 1515793 via cif-deposit CGI script.	1515792.cif