Crystallography Open Database

Information card for entry 1515793

Preview

Coordinates	1515793.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	(bmIm)-Theta-1
Chemical name	[bmIm]-Theta-1
Formula	O16 Si8
Calculated formula	O16 Si8
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	13.824 Å
b	17.42 Å
c	5.052 Å
α	90°
β	90°
γ	90°
Cell volume	1216.59 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	2
Space group number	36
Hermann-Mauguin space group symbol	C m c 21
Hall space group symbol	C 2c -2
Residual factor for all reflections	0.1272
Residual factor for significantly intense reflections	0.104
Weighted residual factors for significantly intense reflections	0.2693
Weighted residual factors for all reflections included in the refinement	0.2851
Goodness-of-fit parameter for all reflections included in the refinement	1.105
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.	1515793.cif
112256	2014-04-30	cif/ Adding structures of 1515792, 1515793 via cif-deposit CGI script.	1515793.cif