Crystallography Open Database

Information card for entry 7131863

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Coordinates	7131863.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	NbocF-AMN
Formula	C24 H36 N2 O4
Calculated formula	C24 H36 N2 O4
Title of publication	Designing vehicle-free anti-bacterial topical hydrogel from Fmoc-diphenylalanine
Authors of publication	Roy, Nabanita; Datta, Hemanta Kumar; Roy, Rajdip; Dastidar, Parthasarathi
Journal of publication	Chemical Communications
Year of publication	2023
a	13.423 ± 0.014 Å
b	6.446 ± 0.007 Å
c	13.679 ± 0.015 Å
α	90°
β	95.363 ± 0.016°
γ	90°
Cell volume	1178 ± 2 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296.15 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	0.1216
Residual factor for significantly intense reflections	0.0544
Weighted residual factors for significantly intense reflections	0.1252
Weighted residual factors for all reflections included in the refinement	0.1584
Goodness-of-fit parameter for all reflections included in the refinement	0.901
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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