Crystallography Open Database

Information card for entry 7110811

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Structure parameters

Formula	C42 H34 Cl2 O8 P2 U
Calculated formula	C42 H34 Cl2 O8 P2 U
Title of publication	A selective uranium extraction agent prepared by polymer imprinting
Authors of publication	Saunders, Gregory D.; Foxon, Simon P.; Walton, Paul H.; Joyce, Malcolm J.; Port, Simon N.
Journal of publication	Chemical Communications
Year of publication	2000
Journal issue	4
Pages of publication	273
a	14.927 ± 0.003 Å
b	8.8708 ± 0.0012 Å
c	15.795 ± 0.003 Å
α	90°
β	97.735 ± 0.015°
γ	90°
Cell volume	2072.5 ± 0.6 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0645
Residual factor for significantly intense reflections	0.034
Weighted residual factors for significantly intense reflections	0.0769
Weighted residual factors for all reflections included in the refinement	0.0871
Goodness-of-fit parameter for all reflections included in the refinement	1.007
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
301857 (current)	2025-08-22	Add cross-references to PubChem compounds in COD range 7/11/ Each referenced PubChem compound corresponds to the full crystal structure.	7110811.cif
180222	2016-03-26	cif/7/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/11/08.	7110811.cif
95927	2014-01-28	cif/ Adding structures of 7110811 via cif-deposit CGI script.	7110811.cif