Crystallography Open Database

Information card for entry 1558328

Preview

Coordinates	1558328.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	catena-poly[aqua(mu-4,4'-bipyridine)(mu-acetato)(uracil-1-acetato)copper(II)] trihydrate
Formula	C18 H22 Cu N4 O9
Calculated formula	C18 H22 Cu N4 O9
Title of publication	A bioinspired metal-organic approach to cross-linked functional 3D nanofibrous hydro- and aero-gels with effective mixture separation of nucleobases by molecular recognition.
Authors of publication	Vegas, V. G.; Beobide, G.; Castillo, O.; Reyes, E.; Gómez-García, C J; Zamora, F.; Amo-Ochoa, P
Journal of publication	Nanoscale
Year of publication	2020
Journal volume	12
Journal issue	27
Pages of publication	14699 - 14707
a	21.561 ± 0.003 Å
b	35.637 ± 0.005 Å
c	11.1216 ± 0.0017 Å
α	90°
β	90°
γ	90°
Cell volume	8545 ± 2 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	5
Space group number	43
Hermann-Mauguin space group symbol	F d d 2
Hall space group symbol	F 2 -2d
Residual factor for all reflections	0.1089
Residual factor for significantly intense reflections	0.057
Weighted residual factors for significantly intense reflections	0.1185
Weighted residual factors for all reflections included in the refinement	0.1395
Goodness-of-fit parameter for all reflections included in the refinement	1.034
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
255031 (current)	2020-08-06	cif/ Updating files of 1558328 Original log message: Adding full bibliography for 1558328.cif.	1558328.cif
253194	2020-06-17	cif/ Adding structures of 1558328 via cif-deposit CGI script.	1558328.cif