Crystallography Open Database

Information card for entry 7063038

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Coordinates	7063038.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H44 N4 O10
Calculated formula	C36 H44 N4 O10
Title of publication	Synthesis of halogenated benzimidazolyl-C-nucleosides and their activity against Leishmania major and Leishmania tropica
Authors of publication	Khan, Umair Ahmed; Choudhary, M. Iqbal; Yousuf, Sammer
Journal of publication	New Journal of Chemistry
Year of publication	2024
Journal volume	48
Journal issue	13
Pages of publication	5605 - 5612
a	9.9303 ± 0.0007 Å
b	17.9109 ± 0.0012 Å
c	10.1057 ± 0.0007 Å
α	90°
β	94.298 ± 0.004°
γ	90°
Cell volume	1792.4 ± 0.2 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 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	0.0443
Residual factor for significantly intense reflections	0.0374
Weighted residual factors for significantly intense reflections	0.0858
Weighted residual factors for all reflections included in the refinement	0.0899
Goodness-of-fit parameter for all reflections included in the refinement	1.064
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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