Crystallography Open Database

Information card for entry 1552704

Preview

Coordinates	1552704.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10 H15 N3 O3
Calculated formula	C10 H15 N3 O3
Title of publication	Pyrimidine Nucleosides from <i>Streptomyces</i> sp. SSA28.
Authors of publication	Xu, Cheng-Dong; Zhang, Hao-Jian; Ma, Zhong-Jun
Journal of publication	Journal of natural products
Year of publication	2019
Journal volume	82
Journal issue	9
Pages of publication	2509 - 2516
a	9.6749 ± 0.0002 Å
b	10.4511 ± 0.0002 Å
c	10.917 ± 0.0002 Å
α	90°
β	98.643 ± 0.002°
γ	90°
Cell volume	1091.32 ± 0.04 Å³
Cell temperature	293.68 ± 0.1 K
Ambient diffraction temperature	293.68 ± 0.1 K
Number of distinct elements	4
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0285
Residual factor for significantly intense reflections	0.0278
Weighted residual factors for significantly intense reflections	0.0718
Weighted residual factors for all reflections included in the refinement	0.0756
Goodness-of-fit parameter for all reflections included in the refinement	1.084
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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