Crystallography Open Database

Information card for entry 7206692

7206691 << 7206692 >> 7206693

Preview

Coordinates	7206692.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H16 Cu Mo4 N6 O15
Calculated formula	C12 H12 Cu Mo4 N6 O15
Title of publication	A series of organopolymolybdate polymers linked by dual fuses: metal‒organic moiety and organic ligand through Mo‒N bonds
Authors of publication	Tian, Ai-xiang; Liu, Xiao-jing; Ying, Jun; Zhu, Dong-xia; Wang, Xiu-li; Peng, Jun
Journal of publication	CrystEngComm
Year of publication	2011
Journal volume	13
Journal issue	22
Pages of publication	6680
a	14.5811 ± 0.0009 Å
b	11.2874 ± 0.0007 Å
c	15.849 ± 0.0009 Å
α	90°
β	106.046 ± 0.001°
γ	90°
Cell volume	2506.8 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0478
Residual factor for significantly intense reflections	0.04
Weighted residual factors for significantly intense reflections	0.1057
Weighted residual factors for all reflections included in the refinement	0.1103
Goodness-of-fit parameter for all reflections included in the refinement	1.025
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
180397 (current)	2016-03-26	cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/66.	7206692.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7206692.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7206692.cif
29984	2011-11-09	../uploads/cif-deposit/cod/cif Adding structures of 7206690, 7206691, 7206692 via cif-deposit CGI script.	7206692.cif