Crystallography Open Database

Information card for entry 7039979

Preview

Coordinates	7039979.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14 H10 Mo2 O4 Sb2
Calculated formula	C14 H10 Mo2 O4 Sb2
SMILES	[cH]12[Mo]3456(C#[O])(C#[O])([cH]([cH]25)[cH]4[cH]13)[Sb]5[Mo]1234([cH]7[cH]4[cH]1[cH]2[cH]37)(C#[O])(C#[O])[Sb]56
Title of publication	Supramolecular adducts based on weak interactions between the trimeric Lewis acid complex (perfluoro-ortho-phenylene)mercury and polypnictogen complexes.
Authors of publication	Fleischmann, Martin; Jones, James S.; Balázs, Gábor; Gabbaï, François P; Scheer, Manfred
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2016
Journal volume	45
Journal issue	35
Pages of publication	13742 - 13749
a	8.6935 ± 0.0004 Å
b	8.6935 ± 0.0004 Å
c	19.7356 ± 0.0014 Å
α	90°
β	90°
γ	120°
Cell volume	1291.73 ± 0.12 Å³
Cell temperature	173.15 K
Ambient diffraction temperature	173.15 K
Number of distinct elements	5
Space group number	154
Hermann-Mauguin space group symbol	P 32 2 1
Hall space group symbol	P 32 2"
Residual factor for all reflections	0.0207
Residual factor for significantly intense reflections	0.0196
Weighted residual factors for significantly intense reflections	0.0519
Weighted residual factors for all reflections included in the refinement	0.0521
Goodness-of-fit parameter for all reflections included in the refinement	1.138
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
186379 (current)	2016-09-10	cif/ Updating files of 7039972, 7039973, 7039974, 7039975, 7039976, 7039977, 7039978, 7039979, 7039980, 7039981 Original log message: Adding full bibliography for 7039972--7039981.cif.	7039979.cif
184575	2016-07-21	cif/ Adding structures of 7039972, 7039973, 7039974, 7039975, 7039976, 7039977, 7039978, 7039979, 7039980, 7039981 via cif-deposit CGI script.	7039979.cif