Crystallography Open Database

Information card for entry 1571523

Preview

Coordinates	1571523.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C54 H121 N8 O49 V18
Calculated formula	C54 H121 N8 O49 V18
Title of publication	Reactivity control of nitrate-incorporating octadecavanadates by changing the oxidation state and metal substitution.
Authors of publication	Yoshida, Isshin; Kikukawa, Yuji; Mitsuhashi, Ryoji; Hayashi, Yoshihito
Journal of publication	Nanoscale
Year of publication	2024
Journal volume	16
Journal issue	22
Pages of publication	10584 - 10589
a	14.9504 ± 0.0003 Å
b	16.4998 ± 0.0003 Å
c	19.5731 ± 0.0003 Å
α	90°
β	90°
γ	90°
Cell volume	4828.27 ± 0.15 Å³
Cell temperature	83 ± 2 K
Ambient diffraction temperature	83 ± 2 K
Number of distinct elements	5
Space group number	18
Hermann-Mauguin space group symbol	P 21 21 2
Hall space group symbol	P 2 2ab
Residual factor for all reflections	0.0424
Residual factor for significantly intense reflections	0.0362
Weighted residual factors for significantly intense reflections	0.0977
Weighted residual factors for all reflections included in the refinement	0.102
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
293178 (current)	2024-07-05	cif/ Updating files of 1571523 Original log message: Adding full bibliography for 1571523.cif.	1571523.cif
291450	2024-05-02	cif/ Adding structures of 1571523 via cif-deposit CGI script.	1571523.cif