Crystallography Open Database

Information card for entry 7219321

7219320 << 7219321 >> 7219322

Preview

Coordinates	7219321.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C60 H64 B Cu4 N30 O42 W12
Calculated formula	C60 H56 B Cu4 N30 O42 W12
Title of publication	Temperature-dependent assembly of two 3D [BW12O40]5−-based coordination polymers with visible light driven photocatalytic properties
Authors of publication	Lu, Xin-Xin; Luo, Yu-Hui; Xu, Yan; Zhang, Hong
Journal of publication	CrystEngComm
Year of publication	2015
Journal volume	17
Journal issue	7
Pages of publication	1631
a	13.1356 ± 0.0007 Å
b	13.2969 ± 0.0007 Å
c	14.4976 ± 0.0007 Å
α	108.632 ± 0.005°
β	92.585 ± 0.004°
γ	97.24 ± 0.004°
Cell volume	2370.5 ± 0.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.0853
Residual factor for significantly intense reflections	0.068
Weighted residual factors for significantly intense reflections	0.1397
Weighted residual factors for all reflections included in the refinement	0.1488
Goodness-of-fit parameter for all reflections included in the refinement	1.053
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
180524 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/93.	7219321.cif
133155	2015-03-06	cif/ Updating files of 7219321, 7219322 Original log message: Adding full bibliography for 7219321--7219322.cif.	7219321.cif
129703	2015-01-17	cif/ Adding structures of 7219321, 7219322 via cif-deposit CGI script.	7219321.cif