Crystallography Open Database

Information card for entry 1570427

Preview

Coordinates	1570427.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C89 H109 N6 O3 P
Calculated formula	C89 H109 N6 O3 P
Title of publication	A library of vinyl phosphonate anions dimerize with cyanostars, form supramolecular polymers and undergo statistical sorting.
Authors of publication	Chen, Yusheng; Kuvayskaya, Anastasia; Pink, Maren; Sellinger, Alan; Flood, Amar H.
Journal of publication	Chemical science
Year of publication	2023
Journal volume	15
Journal issue	1
Pages of publication	389 - 398
a	16.3782 ± 0.0004 Å
b	16.4347 ± 0.0006 Å
c	18.8864 ± 0.0006 Å
α	111.457 ± 0.001°
β	112.34 ± 0.002°
γ	97.462 ± 0.001°
Cell volume	4157.2 ± 0.2 Å³
Cell temperature	153 ± 2 K
Ambient diffraction temperature	153 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1675
Residual factor for significantly intense reflections	0.08
Weighted residual factors for significantly intense reflections	0.2243
Weighted residual factors for all reflections included in the refinement	0.2471
Goodness-of-fit parameter for all reflections included in the refinement	1.086
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
289396 (current)	2024-02-04	cif/ Updating files of 1570426, 1570427, 1570428 Original log message: Adding full bibliography for 1570426--1570428.cif.	1570427.cif
287863	2023-11-30	cif/ Adding structures of 1570426, 1570427, 1570428 via cif-deposit CGI script.	1570427.cif