Crystallography Open Database

Information card for entry 7242907

Preview

Coordinates	7242907.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C27 H39 Cl2 K10 N13.5 O64 V24
Calculated formula	C27 H39 Cl2 K10 N13.5 O64 V24
Title of publication	Supramolecular assembly of a hierarchically structured 3D potassium vanadate framework
Authors of publication	Greiner, Simon; Anjass, Montaha; Streb, Carsten
Journal of publication	CrystEngComm
Year of publication	2021
Journal volume	23
Journal issue	22
Pages of publication	3946 - 3950
a	13.0012 ± 0.0007 Å
b	20.168 ± 0.0008 Å
c	38.2835 ± 0.0016 Å
α	90°
β	93.6201 ± 0.0018°
γ	90°
Cell volume	10018.2 ± 0.8 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 K
Number of distinct elements	7
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	0.1005
Residual factor for significantly intense reflections	0.0792
Weighted residual factors for significantly intense reflections	0.1389
Weighted residual factors for all reflections included in the refinement	0.1469
Goodness-of-fit parameter for all reflections included in the refinement	1.156
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
267111 (current)	2021-07-05	cif/ Updating files of 7242907 Original log message: Adding full bibliography for 7242907.cif.	7242907.cif
265491	2021-05-26	cif/ Adding structures of 7242907 via cif-deposit CGI script.	7242907.cif