Crystallography Open Database

Information card for entry 4324407

Preview

Coordinates	4324407.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C8 H16 Au Cl2 Co N8
Calculated formula	C8 H16 Au Cl2 Co N8
SMILES	C1C[NH2][Co]2([NH2]1)([NH2]CC[NH2]2)(Cl)Cl.[Au](C#N)(C#N)(C#N)C#N
Title of publication	Aggregation of [Au(CN)4]- Anions: Examination by Crystallography and 15N CP-MAS NMR and the Structural Factors Influencing Intermolecular Au...N Interactions
Authors of publication	Andrew R. Geisheimer; John E. C. Wren; Vladimir K. Michaelis; Masayuki Kobayashi; Ken Sakai; Scott Kroeker; Daniel B. Leznoff
Journal of publication	Inorganic Chemistry
Year of publication	2011
Journal volume	50
Pages of publication	1265 - 1274
a	8.7523 ± 0.0005 Å
b	8.0191 ± 0.0005 Å
c	11.7635 ± 0.0008 Å
α	90°
β	94.729 ± 0.003°
γ	90°
Cell volume	822.82 ± 0.09 Å³
Cell temperature	293 K
Ambient diffraction temperature	293 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/a 1
Hall space group symbol	-P 2yab
Residual factor for all reflections	0.1512
Residual factor for significantly intense reflections	0.1011
Weighted residual factors for all reflections	0.1242
Weighted residual factors for significantly intense reflections	0.1072
Weighted residual factors for all reflections included in the refinement	0.1047
Goodness-of-fit parameter for all reflections included in the refinement	1.0162
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
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4324407.cif
132410	2015-02-25	cod/ (robertas@burundukas) Replaced zero-length value of the tag '_chemical_name_systematic' with '?'. codsql 'select file, chemname from data \ where length(chemname) = 0' -NB \ \| perl -ne 'print $1."\n" if /\b(\d{7})\s$/' \ \| codid2file \ \| xargs perl -0777 -i -pe 's/\b_chemical_name_systematic \K \s? ( \n ; \s? \n ; \| '\'' \s '\'' \s*? ) (?=\n) /" " x8 . "?"/ixmse'	4324407.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4324407.cif
41115	2012-03-12	../uploads/cif-deposit/cod/cif Adding structures of 4324407 via cif-deposit CGI script.	4324407.cif