Crystallography Open Database

Information card for entry 7245196

Preview

Coordinates	7245196.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C23 H27 O6 P
Calculated formula	C23 H27 O6 P
SMILES	CC1(C)O[C@@H]2[C@@H](CO1)OC[C@H]([C@@H]2OC(=O)C)P(=O)(c1ccccc1)c1ccccc1
Title of publication	Photo-mediated synthesis of 1,2-dideoxy-2-phosphinylated carbohydrates from glycals: the reduction of glycosyl radicals to glycosyl anions
Authors of publication	Li, Hai; Yu, Kai-Cheng; Su, Jia-Kun; Ouyang, Wei; Fan, Nai-Li; Hu, Xiang-Guo
Journal of publication	Green Chemistry
Year of publication	2022
Journal volume	24
Journal issue	21
Pages of publication	8280 - 8291
a	9.4927 ± 0.0005 Å
b	9.4927 ± 0.0005 Å
c	47.965 ± 0.005 Å
α	90°
β	90°
γ	90°
Cell volume	4322.2 ± 0.6 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	4
Space group number	92
Hermann-Mauguin space group symbol	P 41 21 2
Hall space group symbol	P 4abw 2nw
Residual factor for all reflections	0.0505
Residual factor for significantly intense reflections	0.0454
Weighted residual factors for significantly intense reflections	0.0966
Weighted residual factors for all reflections included in the refinement	0.0988
Goodness-of-fit parameter for all reflections included in the refinement	1.145
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
278992 (current)	2022-11-07	cif/ Updating files of 7245196, 7245197 Original log message: Adding full bibliography for 7245196--7245197.cif.	7245196.cif
276858	2022-07-23	cif/ Adding structures of 7245196, 7245197 via cif-deposit CGI script.	7245196.cif