Crystallography Open Database

Information card for entry 7159437

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Coordinates	7159437.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C19 H19 N5 O6
Calculated formula	C19 H19 N5 O6
Title of publication	Synthesis of purine derivatives of Me-TaNA and properties of Me-TaNA-modified oligonucleotides.
Authors of publication	Fuchi, Yasufumi; Watanabe, Kouki; Shoji, Misa; Ito, Yuta; Hari, Yoshiyuki
Journal of publication	Organic & biomolecular chemistry
Year of publication	2023
Journal volume	21
Journal issue	25
Pages of publication	5203 - 5213
a	23.66 ± 0.002 Å
b	6.1601 ± 0.0006 Å
c	14.0178 ± 0.0013 Å
α	90°
β	112.573 ± 0.002°
γ	90°
Cell volume	1886.5 ± 0.3 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	4
Space group number	5
Hermann-Mauguin space group symbol	C 1 2 1
Hall space group symbol	C 2y
Residual factor for all reflections	0.0367
Residual factor for significantly intense reflections	0.0365
Weighted residual factors for significantly intense reflections	0.0972
Weighted residual factors for all reflections included in the refinement	0.0974
Goodness-of-fit parameter for all reflections included in the refinement	1.029
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKa
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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