Crystallography Open Database

Information card for entry 4500703

Preview

Coordinates	4500703.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H56 N2 O30 P8 U2
Calculated formula	C40 H58 N2 O30 P8 U2
Title of publication	Hydrothermal Synthesis and Structural Characterization of Organically Templated Uranyl Diphosphonate Compounds
Authors of publication	Adelani, Pius O.; Oliver, Allen G.; Albrecht-Schmitt, Thomas E.
Journal of publication	Crystal Growth & Design
Year of publication	2011
Journal volume	11
Journal issue	5
Pages of publication	1966
a	16.651 ± 0.004 Å
b	20.376 ± 0.004 Å
c	8.7419 ± 0.0019 Å
α	90°
β	90°
γ	90°
Cell volume	2966 ± 1.1 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Residual factor for all reflections	0.0579
Residual factor for significantly intense reflections	0.0391
Weighted residual factors for significantly intense reflections	0.0907
Weighted residual factors for all reflections included in the refinement	0.1004
Goodness-of-fit parameter for all reflections included in the refinement	1.057
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
179538 (current)	2016-03-24	cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/07.	4500703.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4500703.cif
34591	2012-02-25	../uploads/cif-deposit/cod/cif Adding structures of 4500702, 4500703, 4500704 via cif-deposit CGI script.	4500703.cif