Crystallography Open Database

Information card for entry 7156145

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Structure parameters

Formula	C33 H25 O2 P
Calculated formula	C33 H25 O2 P
Title of publication	Eosin Y-catalyzed, visible-light-promoted carbophosphinylation of allylic alcohols via a radical neophyl rearrangement.
Authors of publication	Yin, Yao; Weng, Wei-Zhi; Sun, Jian-Guo; Zhang, Bo
Journal of publication	Organic & biomolecular chemistry
Year of publication	2018
Journal volume	16
Journal issue	13
Pages of publication	2356 - 2361
a	11.149 ± 0.002 Å
b	11.921 ± 0.002 Å
c	18.456 ± 0.004 Å
α	90°
β	90°
γ	90°
Cell volume	2452.9 ± 0.8 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 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	0.0505
Residual factor for significantly intense reflections	0.0459
Weighted residual factors for significantly intense reflections	0.1252
Weighted residual factors for all reflections included in the refinement	0.1304
Goodness-of-fit parameter for all reflections included in the refinement	1.033
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
301861 (current)	2025-08-22	Add cross-references to PubChem compounds in COD range 7/15/ Each referenced PubChem compound corresponds to the full crystal structure.	7156145.cif
230784	2019-11-17	cif/ Updating files of 7156145 Original log message: Adding full bibliography for 7156145.cif.	7156145.cif
206885	2018-03-10	cif/ Adding structures of 7156145 via cif-deposit CGI script.	7156145.cif