Crystallography Open Database

Information card for entry 4333802

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Structure parameters

Formula	C12 H10 As2 N2 O9
Calculated formula	C12 H10 As2 N2 O9
SMILES	O[As](O[As](c1c(cccc1)N(=O)=O)(=O)O)(c1c(cccc1)N(=O)=O)=O
Title of publication	Silver Pyroarsonates Obtained from Ag(I)-Mediated in Situ Condensation of Aryl Arsonate Ligands under Solvothermal Conditions
Authors of publication	Xiang-Ying Qian; Jun-Ling Song; Jiang-Gao Mao
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	1843 - 1853
a	8.436 ± 0.005 Å
b	7.843 ± 0.005 Å
c	23.14 ± 0.014 Å
α	90°
β	90°
γ	90°
Cell volume	1531 ± 1.6 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	60
Hermann-Mauguin space group symbol	P b c n
Hall space group symbol	-P 2n 2ab
Residual factor for all reflections	0.041
Residual factor for significantly intense reflections	0.0349
Weighted residual factors for significantly intense reflections	0.0835
Weighted residual factors for all reflections included in the refinement	0.087
Goodness-of-fit parameter for all reflections included in the refinement	1.045
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
301839 (current)	2025-08-21	Add cross-references to PubChem compounds in COD range 4/33/ Each referenced PubChem compound corresponds to the full crystal structure.	4333802.cif
179441	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/38.	4333802.cif
99610	2014-02-03	cif/ Adding structures of 4333802 via cif-deposit CGI script.	4333802.cif