Crystallography Open Database

Information card for entry 7062735

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Coordinates	7062735.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C19 H17 N O5
Calculated formula	C19 H17 N O5
Title of publication	C(3)-Aryl isoindolinones: a PTSA-mediated access and improved synthesis of (±)-nuevamine
Authors of publication	Rao, H. Surya Prakash; J, Prabhakaran
Journal of publication	New Journal of Chemistry
Year of publication	2023
Journal volume	47
Journal issue	41
Pages of publication	19283 - 19288
a	10.6688 ± 0.0005 Å
b	11.5902 ± 0.0005 Å
c	12.7186 ± 0.0005 Å
α	90°
β	90°
γ	90°
Cell volume	1572.7 ± 0.12 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	4
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	0.0478
Residual factor for significantly intense reflections	0.0368
Weighted residual factors for significantly intense reflections	0.0867
Weighted residual factors for all reflections included in the refinement	0.095
Goodness-of-fit parameter for all reflections included in the refinement	1.056
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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