Crystallography Open Database

Information card for entry 7024158

Preview

Coordinates	7024158.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C53 H24 F72 K8 O8
Calculated formula	C53 H24 F72 K8 O8
Title of publication	Three-coordinate late transition metal fluorinated alkoxide complexes.
Authors of publication	Cantalupo, Stefanie A.; Lum, June S.; Buzzeo, Marisa C.; Moore, Curtis; DiPasquale, Antonio G.; Rheingold, Arnold L.; Doerrer, Linda H.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2010
Journal volume	39
Journal issue	2
Pages of publication	374 - 383
a	21.061 ± 0.011 Å
b	21.046 ± 0.011 Å
c	21.082 ± 0.01 Å
α	90°
β	113.734 ± 0.006°
γ	90°
Cell volume	8554 ± 8 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0679
Residual factor for significantly intense reflections	0.0396
Weighted residual factors for significantly intense reflections	0.0852
Weighted residual factors for all reflections included in the refinement	0.1002
Goodness-of-fit parameter for all reflections included in the refinement	1.038
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179946 (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 7/02/41.	7024158.cif
92212	2014-01-12	cif/ Adding structures of 7024158, 7024159, 7024160, 7024161, 7024162, 7024163 via cif-deposit CGI script.	7024158.cif