Crystallography Open Database

Information card for entry 7001952

7001951 << 7001952 >> 7001953

Preview

Coordinates	7001952.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H66 Ag4 I4 N4 O2 P2
Calculated formula	C42 H66 Ag4 I4 N4 O2 P2
Title of publication	Unprecedented cubane-type silver cluster with a novel phosphinite functionalized N-heterocyclic carbene ligand
Authors of publication	Raynal, Matthieu; Liu, Xianghao; Pattacini, Roberto; Vallée, Christophe; Olivier-Bourbigou, Hélène; Braunstein, Pierre
Journal of publication	Dalton Transactions
Year of publication	2009
Journal issue	35
Pages of publication	7288
a	17.0929 ± 0.0008 Å
b	17.4818 ± 0.0008 Å
c	35.3573 ± 0.0011 Å
α	90°
β	90°
γ	90°
Cell volume	10565.3 ± 0.8 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	7
Space group number	45
Hermann-Mauguin space group symbol	I b a 2
Hall space group symbol	I 2 -2c
Residual factor for all reflections	0.0605
Residual factor for significantly intense reflections	0.048
Weighted residual factors for significantly intense reflections	0.1297
Weighted residual factors for all reflections included in the refinement	0.145
Goodness-of-fit parameter for all reflections included in the refinement	1.12
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
179717 (current)	2016-03-25	cif/7/00/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/00/19.	7001952.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7001952.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7001952.cif
1143	2010-05-03	cif/7/ Adding CIFs from Dalton-Trans-2009/ deposition.	7001952.cif