Crystallography Open Database

Information card for entry 2204930

2204929 << 2204930 >> 2204931

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Structure parameters

Chemical name	diaquatetrakis(μ-1,2-benzenedicarboxylato)di-μ-nitrato-pentastrontium(II)
Formula	C32 H20 N2 O24 Sr5
Calculated formula	C32 H20 N2 O24 Sr5
SMILES	c1(ccccc1C(=O)[O-])C(=O)[O-].[Sr+2].O=N([O-])=O.[Sr+2].[O-]C(=O)c1c(cccc1)C(=O)[O-].O.[Sr+2].O=C(c1ccccc1C(=O)[O-])[O-].[Sr+2].O=N([O-])=O.[Sr+2].[O-]C(=O)c1c(cccc1)C(=O)[O-].O
Title of publication	Polymeric diaquatetrakis(μ-1,2-benzenedicarboxylato)di-μ-nitrato-pentastrontium(II)
Authors of publication	Stein, Irena; Ruschewitz, Uwe
Journal of publication	Acta Crystallographica Section E
Year of publication	2005
Journal volume	61
Journal issue	1
Pages of publication	m141 - m143
a	7.0624 ± 0.0011 Å
b	10.3895 ± 0.0016 Å
c	12.7945 ± 0.0019 Å
α	91.557 ± 0.012°
β	91.519 ± 0.012°
γ	104.011 ± 0.012°
Cell volume	910 ± 0.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.0568
Residual factor for significantly intense reflections	0.0338
Weighted residual factors for significantly intense reflections	0.0775
Weighted residual factors for all reflections included in the refinement	0.0912
Goodness-of-fit parameter for all reflections included in the refinement	1.033
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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