Crystallography Open Database

Information card for entry 4510157

Preview

Coordinates	4510157.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H64 As6 Cu3 Mo6 N16 O42
Calculated formula	C24 H58 As6 Cu3 Mo6 N16 O42
Title of publication	Novel One-Dimensional Organic‒Inorganic Polyoxometalate Hybrids Constructed from Heteropolymolybdate Units and Copper‒Aminoacid Complexes
Authors of publication	Zhao, Jun-Wei; Zhang, Jing-Li; Li, Yan-Zhou; Cao, Jing; Chen, Li-Juan
Journal of publication	Crystal Growth & Design
Year of publication	2014
Journal volume	14
Journal issue	3
Pages of publication	1467
a	10.3413 ± 0.0013 Å
b	11.9522 ± 0.0016 Å
c	13.6997 ± 0.0017 Å
α	104.168 ± 0.002°
β	96.189 ± 0.002°
γ	95.169 ± 0.002°
Cell volume	1620.3 ± 0.4 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0678
Residual factor for significantly intense reflections	0.0576
Weighted residual factors for significantly intense reflections	0.1554
Weighted residual factors for all reflections included in the refinement	0.1596
Goodness-of-fit parameter for all reflections included in the refinement	1.089
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
179648 (current)	2016-03-24	cif/4/51/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/51/01.	4510157.cif
106371	2014-03-15	cif/ Adding structures of 4510157, 4510158 via cif-deposit CGI script.	4510157.cif