Crystallography Open Database

Information card for entry 7029231

Preview

Coordinates	7029231.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C92 H152 K2 O18 P2
Calculated formula	C84 H136 K2 O16 P2
Title of publication	Secondary diphosphine and diphosphido ligands: synthesis, characterisation and group 1 coordination compounds.
Authors of publication	Ritch, Jamie S.; Julienne, Delphine; Rybchinski, Shayne R.; Brockman, Kathryne S.; Johnson, Kevin R. D.; Hayes, Paul G.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2014
Journal volume	43
Journal issue	1
Pages of publication	267 - 276
a	13.3096 ± 0.0019 Å
b	17.99 ± 0.003 Å
c	21.542 ± 0.003 Å
α	87.891 ± 0.002°
β	87.743 ± 0.002°
γ	68.936 ± 0.002°
Cell volume	4808.2 ± 1.3 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1122
Residual factor for significantly intense reflections	0.0642
Weighted residual factors for significantly intense reflections	0.1624
Weighted residual factors for all reflections included in the refinement	0.1805
Goodness-of-fit parameter for all reflections included in the refinement	1.028
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
179998 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/92.	7029231.cif
105549	2014-03-12	cif/ Adding structures of 7029228, 7029229, 7029230, 7029231, 7029232 via cif-deposit CGI script.	7029231.cif