Crystallography Open Database

Information card for entry 7031053

Preview

Coordinates	7031053.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C122 H132 Li4 N4 P4
Calculated formula	C110 H120 Li4 N4 P4
Title of publication	Syntheses, structures and flexible coordination of sterically demanding di- and "tri"-lithiated methandiides.
Authors of publication	Sindlinger, Christian P.; Stasch, Andreas
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2014
Journal volume	43
Journal issue	38
Pages of publication	14334 - 14345
a	18.743 ± 0.004 Å
b	34.226 ± 0.007 Å
c	17.098 ± 0.003 Å
α	90°
β	91.7 ± 0.03°
γ	90°
Cell volume	10964 ± 4 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
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	0.0768
Residual factor for significantly intense reflections	0.0566
Weighted residual factors for significantly intense reflections	0.1466
Weighted residual factors for all reflections included in the refinement	0.1546
Goodness-of-fit parameter for all reflections included in the refinement	1.051
Diffraction radiation wavelength	0.7109 Å
Diffraction radiation type	synchrotron
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
180016 (current)	2016-03-25	cif/7/03/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/03/10.	7031053.cif
124703	2014-10-06	cif/ Updating files of 7031052, 7031053, 7031054, 7031055, 7031056, 7031057, 7031058, 7031059, 7031060 Original log message: Adding full bibliography for 7031052--7031060.cif.	7031053.cif
114589	2014-05-28	cif/ Adding structures of 7031052, 7031053, 7031054, 7031055, 7031056, 7031057, 7031058, 7031059, 7031060 via cif-deposit CGI script.	7031053.cif