Crystallography Open Database

Information card for entry 4302073

4302072 << 4302073 >> 4302074

Preview

Coordinates	4302073.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H17 N5 O18 Pr2
Calculated formula	C24 H17 N5 O18 Pr2
Title of publication	Syntheses, Crystal Structures, and Gas Storage Studies in New Three-Dimensional 5-Aminoisophthalate Praseodymium Polymeric Complexes
Authors of publication	Yongcai Qiu; Hong Deng; Shihe Yang; Jixia Mou; Carole Daiguebonne; Nicolas Kerbellec; Olivier Guillou; Stuart R. Batten
Journal of publication	Inorganic Chemistry
Year of publication	2009
Journal volume	48
Pages of publication	3976 - 3981
a	8.5785 ± 0.0004 Å
b	31.9322 ± 0.0015 Å
c	13.8236 ± 0.0007 Å
α	90°
β	90°
γ	90°
Cell volume	3786.7 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
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	0.0545
Residual factor for significantly intense reflections	0.0349
Weighted residual factors for significantly intense reflections	0.0849
Weighted residual factors for all reflections included in the refinement	0.0901
Goodness-of-fit parameter for all reflections included in the refinement	1
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
179058 (current)	2016-03-22	cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/20.	4302073.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4302073.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4302073.cif
1054	2010-03-28	cif/4/ Adding data extracted in Inorg-Chem-2009_01-10/ processing.	4302073.cif