Crystallography Open Database

Information card for entry 4319357

4319356 << 4319357 >> 4319358

Preview

Coordinates	4319357.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Bis([2.2.2]-cryptand) Palladium-bis(maleonitrilediselenolate)
Formula	C44 H72 K2 N8 O12 Pd Se4
Calculated formula	C43.064 H72 K2 N7.532 O12 Pd Se4.468
Title of publication	Syntheses and Characterization of the Metal Maleonitrilediselenolates [K([2.2.2]-cryptand)]2[M(Se2C2(CN)2)2] (M = Ni, Pd, Pt) and [Ni(dmf)5Cl]2[Ni(Se2C2(CN)2)2]
Authors of publication	Craig C. McLauchlan; Scott D. Robowski; James A. Ibers
Journal of publication	Inorganic Chemistry
Year of publication	2001
Journal volume	40
Pages of publication	1372 - 1375
a	12.2906 ± 0.0008 Å
b	15.6686 ± 0.001 Å
c	15.5476 ± 0.001 Å
α	90°
β	108.554 ± 0.011°
γ	90°
Cell volume	2838.5 ± 0.4 Å³
Cell temperature	153 ± 2 K
Ambient diffraction temperature	153 ± 2 K
Number of distinct elements	7
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	0.0899
Residual factor for significantly intense reflections	0.0436
Weighted residual factors for significantly intense reflections	0.085
Weighted residual factors for all reflections included in the refinement	0.0904
Goodness-of-fit parameter for all reflections included in the refinement	0.856
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
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.	4319357.cif
120093	2014-07-12	Adding DOIs to range 4/31 structures.	4319357.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4319357.cif
16089	2011-03-20	../uploads/cif-deposit/cod/cif Adding structures of 4319357 via cif-deposit CGI script.	4319357.cif