Crystallography Open Database

Information card for entry 2001390

2001389 << 2001390 >> 2001391

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Coordinates	2001390.cif
Original IUCr paper	HTML

Structure parameters

Formula	C10 H8 N2 O6
Calculated formula	C10 H8 N2 O6
Title of publication	Structure of 2-methoxycarbonyl-1,4-dinitrocubane
Authors of publication	Ammon, H. L.; Bashir-Hashemi, A.
Journal of publication	Acta Crystallographica Section C
Year of publication	1993
Journal volume	49
Journal issue	9
Pages of publication	1641 - 1643
a	13.484 ± 0.003 Å
b	22.325 ± 0.003 Å
c	6.987 ± 0.001 Å
α	90°
β	90°
γ	90°
Cell volume	2103.3 ± 0.6 Å³
Cell temperature	293 K
Number of distinct elements	4
Hermann-Mauguin space group symbol	P 21 21 2
Hall space group symbol	P 2 2ab
Residual factor for significantly intense reflections	0.05
Weighted residual factors for significantly intense reflections	0.066
Goodness-of-fit parameter for significantly intense reflections	1.5
Diffraction radiation wavelength	1.5418 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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