Crystallography Open Database

Information card for entry 2008396

2008395 << 2008396 >> 2008397

Preview

Coordinates	2008396.cif
Original IUCr paper	HTML

Structure parameters

Formula	C6 H16 Cl2 N4 O10
Calculated formula	C6 H16 Cl2 N4 O10
SMILES	C(=O)(NCC[NH3+])C(=O)NCC[NH3+].Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-]
Title of publication	<i>N</i>,<i>N</i>'-Bis(2-ammonioethyl)oxamide diperchlorate
Authors of publication	Cheng-Yong Su; Wen-Jun Zhang; Bei-Sheng Kang
Journal of publication	Acta Crystallographica Section C
Year of publication	1999
Journal volume	55
Journal issue	4
Pages of publication	636 - 637
a	8.517 ± 0.002 Å
b	7.731 ± 0.002 Å
c	10.83 ± 0.002 Å
α	90°
β	90.38 ± 0.03°
γ	90°
Cell volume	713.1 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0721
Residual factor for significantly intense reflections	0.0662
Weighted residual factors for all reflections	0.1746
Weighted residual factors for significantly intense reflections	0.1681
Goodness-of-fit parameter for all reflections	1.115
Goodness-of-fit parameter for significantly intense reflections	1.115
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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