Crystallography Open Database

Information card for entry 2228327

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Structure parameters

Chemical name	<i>catena</i>-Poly[[(benzoato-κ^2^<i>O</i>,<i>O</i>')(2,2'-bipyridine- κ^2^<i>N</i>,<i>N</i>')lead(II)]-μ~3~-nitrato- κ^4^<i>O</i>:<i>O</i>,<i>O</i>':<i>O</i>'']
Formula	C17 H13 N3 O5 Pb
Calculated formula	C17 H13 N3 O5 Pb
SMILES	c1cccc2c3cccc[n]3[Pb]3([n]12)OC(=[O]3)c1ccccc1.N(=O)(=O)[O-]
Title of publication	<i>catena</i>-Poly[[(benzoato-κ^2^<i>O</i>,<i>O</i>')(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')lead(II)]-μ~3~-nitrato-κ^4^<i>O</i>:<i>O</i>,<i>O</i>':<i>O</i>'']
Authors of publication	Yang, Juan; Dai, Jun; Wang, Xiaohan
Journal of publication	Acta Crystallographica Section E
Year of publication	2010
Journal volume	66
Journal issue	12
Pages of publication	m1686
a	6.5389 ± 0.0011 Å
b	8.5052 ± 0.0014 Å
c	15.548 ± 0.003 Å
α	84.566 ± 0.003°
β	86.593 ± 0.003°
γ	83.729 ± 0.002°
Cell volume	854.6 ± 0.3 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0395
Residual factor for significantly intense reflections	0.037
Weighted residual factors for significantly intense reflections	0.0971
Weighted residual factors for all reflections included in the refinement	0.0988
Goodness-of-fit parameter for all reflections included in the refinement	1.024
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

Version history

Revision	Date	Message	Files
181204 (current)	2016-04-03	hkl/2/22/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/22/83.	2228327.cif 2228327.hkl
176789	2016-02-20	cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/22.	2228327.cif 2228327.hkl
120072	2014-07-11	Adding DOIs to range 2 structures.	2228327.cif 2228327.hkl
88064	2013-08-29	Adding _cod_database_fobs_code data item to all COD CIFs that have Fobs deposited and did not have this data item yet.	2228327.cif 2228327.hkl
26848	2011-09-28	cif/2/, hkl/2/, html/ Reorganising CIFs of the range 2* into the "prefix-directory" tree.	2228327.cif 2228327.hkl
11387	2011-02-15	hkl/: Adding Reflection data for the recently deposited IUCr-originating structures.	2228327.cif 2228327.hkl
5776	2011-01-06	../uploads/cif-deposit/cod/cif Adding structures of 2228322, 2228323, 2228324, 2228325, 2228326, 2228327, 2228328, 2228329, 2228330, 2228331 via cif-deposit CGI script.	2228327.cif