Crystallography Open Database

Information card for entry 7235522

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Coordinates	7235522.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14 H17 N O4 S
Calculated formula	C14 H17 N O4 S
Title of publication	Synthesis of glycopeptoid sulfonamides diversifying N-glycopeptide linkage region mimics
Authors of publication	Singhamahapatra, Anadi; Sahoo, Laxminarayan; Varghese, Babu; Loganathan, Duraikkannu
Journal of publication	RSC Advances
Year of publication	2014
Journal volume	4
Journal issue	35
Pages of publication	18038
a	6.5378 ± 0.0001 Å
b	12.7943 ± 0.0003 Å
c	17.9426 ± 0.0004 Å
α	90°
β	90°
γ	90°
Cell volume	1500.84 ± 0.05 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	5
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.029
Residual factor for significantly intense reflections	0.0266
Weighted residual factors for significantly intense reflections	0.0745
Weighted residual factors for all reflections included in the refinement	0.0775
Goodness-of-fit parameter for all reflections included in the refinement	1.064
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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