Crystallography Open Database

Information card for entry 4327304

Preview

Coordinates	4327304.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C4 H62 Cl Li9 Mo6 N2 O62 P8
Calculated formula	C4 H10 Cl Li9 Mo6 N1.5 O57.5 P8
Title of publication	Synthesis and Characterization of Octa- and Hexanuclear Polyoxomolybdate Wheels: Role of the Inorganic Template and of the Counterion
Authors of publication	Anne Dolbecq; Laurent Lisnard; Pierre Mialane; Jérôme Marrot; Marc Bénard; Marie-Madeleine Rohmer; Francis Sécheresse
Journal of publication	Inorganic Chemistry
Year of publication	2006
Journal volume	45
Pages of publication	5898 - 5910
a	13.7096 ± 0.0002 Å
b	14.2642 ± 0.0002 Å
c	17.4993 ± 0.0003 Å
α	101.401 ± 0.001°
β	104.101 ± 0.001°
γ	108.799 ± 0.001°
Cell volume	2996.41 ± 0.09 Å³
Cell temperature	273 ± 2 K
Ambient diffraction temperature	273 ± 2 K
Number of distinct elements	8
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0944
Residual factor for significantly intense reflections	0.0614
Weighted residual factors for significantly intense reflections	0.1543
Weighted residual factors for all reflections included in the refinement	0.1792
Goodness-of-fit parameter for all reflections included in the refinement	1.068
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
179376 (current)	2016-03-23	cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/73.	4327304.cif
120105	2014-07-12	Adding DOIs to range 4/32 structures.	4327304.cif
61020	2012-06-20	cif/ Adding structures of 4327304 via cif-deposit CGI script.	4327304.cif