Crystallography Open Database

Information card for entry 1520707

1520706 << 1520707 >> 1520708

Preview

Coordinates	1520707.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H23 N O8
Calculated formula	C20 H23 N O8
Title of publication	Total Synthesis of (+)-3-Demethoxyerythratidinone and (+)-Erysotramidine via the Oxidative Amidation of a Phenol.
Authors of publication	Paladino, Marco; Zaifman, Joshua; Ciufolini, Marco A.
Journal of publication	Organic letters
Year of publication	2015
Journal volume	17
Journal issue	14
Pages of publication	3422 - 3425
a	8.7215 ± 0.0006 Å
b	11.3257 ± 0.0008 Å
c	19.217 ± 0.001 Å
α	90°
β	90°
γ	90°
Cell volume	1898.2 ± 0.2 Å³
Cell temperature	90 ± 0.1 K
Ambient diffraction temperature	90 ± 0.1 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	0.0277
Residual factor for significantly intense reflections	0.0269
Weighted residual factors for significantly intense reflections	0.0672
Weighted residual factors for all reflections included in the refinement	0.068
Goodness-of-fit parameter for all reflections included in the refinement	1.072
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176428 (current)	2016-02-13	Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively.	1520707.cif
152918	2015-08-05	cif/ Updating files of 1520707 Original log message: Adding full bibliography for 1520707.cif.	1520707.cif
139825	2015-07-01	cif/ Adding structures of 1520707 via cif-deposit CGI script.	1520707.cif