Crystallography Open Database

Information card for entry 1570484

Preview

Coordinates	1570484.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C41 H42 Al2 Cl4 N4
Calculated formula	C41 H42 Al2 Cl4 N4
Title of publication	Lewis acid catalysed polymerisation of cyclopentenone.
Authors of publication	Dissanayake, Deepamali; Draper, Alysia; Liu, Zhizhou; Jaunnoo, Neelofur; Haven, Joris J.; Forsyth, Craig; McKay, Alasdair I.; Junkers, Tanja; Vidović, Dragoslav
Journal of publication	Chemical science
Year of publication	2024
Journal volume	15
Journal issue	2
Pages of publication	639 - 643
a	6.2994 ± 0.0001 Å
b	22.3513 ± 0.0004 Å
c	14.5043 ± 0.0002 Å
α	90°
β	90.524 ± 0.001°
γ	90°
Cell volume	2042.12 ± 0.06 Å³
Cell temperature	123 ± 2 K
Ambient diffraction temperature	123 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0517
Residual factor for significantly intense reflections	0.0483
Weighted residual factors for significantly intense reflections	0.1346
Weighted residual factors for all reflections included in the refinement	0.1383
Goodness-of-fit parameter for all reflections included in the refinement	1.071
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
289422 (current)	2024-02-04	cif/ Updating files of 1570482, 1570483, 1570484 Original log message: Adding full bibliography for 1570482--1570484.cif.	1570484.cif
287948	2023-12-03	cif/ Adding structures of 1570482, 1570483, 1570484 via cif-deposit CGI script.	1570484.cif