Crystallography Open Database

Information card for entry 4319325

4319324 << 4319325 >> 4319326

Preview

Coordinates	4319325.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H14 Au F6 N2 O2 P
Calculated formula	C16 H14 Au F6 N2 O2 P
Title of publication	Syntheses and Characterization of Gold(III) Tetradentate Schiff Base Complexes. X-ray Crystal Structures of [Au(sal2pn)]Cl.2.5H2O and [Au(sal2en)]PF6
Authors of publication	Steven L. Barnholtz; John D. Lydon; Gloria Huang; Meera Venkatesh; Charles L. Barnes; Alan R. Ketring; Silvia S. Jurisson
Journal of publication	Inorganic Chemistry
Year of publication	2001
Journal volume	40
Pages of publication	972 - 976
a	7.273 ± 0.0009 Å
b	10.993 ± 0.0014 Å
c	12.1882 ± 0.0016 Å
α	112.472 ± 0.002°
β	93.631 ± 0.002°
γ	98.251 ± 0.002°
Cell volume	883.7 ± 0.2 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0393
Residual factor for significantly intense reflections	0.0365
Weighted residual factors for significantly intense reflections	0.0995
Weighted residual factors for all reflections included in the refinement	0.1024
Goodness-of-fit parameter for all reflections included in the refinement	0.902
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179273 (current)	2016-03-23	cif/4/31/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/31/93.	4319325.cif
120093	2014-07-12	Adding DOIs to range 4/31 structures.	4319325.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4319325.cif
17004	2011-03-31	cif/ Commiting CIFs, that were updated with the 'cif_fix_values' script, using options '--fix-misspelled replacement_values.lst', '--fix-temperature' and '--fix-enums' with built-in table of enum values. The following cmd was used: > (set -x; find ? -name \*.cif \| sort \| xargs -i sh -c 'if !( > cif_fix_values --fix-misspelled ~/../inputs/replacament_values.lst {} \| > cif_filter --add-cif-header {} \| > sponge {} ) 2>&1 \| grep NOTE; then svn revert {}; > fi' ) &	4319325.cif
16057	2011-03-19	../uploads/cif-deposit/cod/cif Adding structures of 4319325 via cif-deposit CGI script.	4319325.cif