Crystallography Open Database

Information card for entry 2004204

2004203 << 2004204 >> 2004205

Preview

Coordinates	2004204.cif
Original IUCr paper	HTML

Structure parameters

Formula	C4 H4 I N3 O
Calculated formula	C4 H4 I N3 O
Title of publication	5-Iodocytosine
Authors of publication	Okabe, N.; Tamaki, K.; Suga, T.
Journal of publication	Acta Crystallographica Section C
Year of publication	1995
Journal volume	51
Journal issue	12
Pages of publication	2696 - 2698
a	18.248 ± 0.001 Å
b	4.442 ± 0.003 Å
c	15.913 ± 0.002 Å
α	90°
β	98.366 ± 0.006°
γ	90°
Cell volume	1276.1 ± 0.9 Å³
Cell temperature	296 K
Number of distinct elements	5
Hermann-Mauguin space group symbol	C 1 2 1
Residual factor for significantly intense reflections	0.04
Weighted residual factors for significantly intense reflections	0.045
Goodness-of-fit parameter for significantly intense reflections	1.75
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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