Crystallography Open Database

Information card for entry 7110314

Preview

Coordinates	7110314.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H54 I2 Li4 N4 O4
Calculated formula	C28 H54 I2 Li4 N4 O4
Title of publication	Asymmetric lithium(i) and copper(ii) alkoxy-N-heterocyclic carbene complexes; crystallographic characterisation and Lewis acid catalysisElectronic supplementary information (ESI) available: full synthetic and structural details. See http://www.rsc.org/suppdata/cc/b4/b404614e/
Authors of publication	Arnold, Polly L.; Rodden, Mark; Davis, Kate M.; Scarisbrick, Andrew C.; Blake, Alexander J.; Wilson, Claire
Journal of publication	Chemical Communications
Year of publication	2004
Journal issue	14
Pages of publication	1612 - 1613
a	12.8799 ± 0.0015 Å
b	15.655 ± 0.002 Å
c	19.034 ± 0.002 Å
α	90°
β	93.239 ± 0.002°
γ	90°
Cell volume	3831.8 ± 0.8 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0574
Residual factor for significantly intense reflections	0.0362
Weighted residual factors for significantly intense reflections	0.0854
Weighted residual factors for all reflections included in the refinement	0.0975
Goodness-of-fit parameter for all reflections included in the refinement	0.922
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
180217 (current)	2016-03-26	cif/7/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/11/03.	7110314.cif
94357	2014-01-23	cif/ Adding structures of 7110310, 7110311, 7110312, 7110313, 7110314, 7110315 via cif-deposit CGI script.	7110314.cif