Crystallography Open Database

Information card for entry 1569614

Preview

Coordinates	1569614.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C88 H123 Al3 N6 O0 S Y2
Calculated formula	C88 H123 Al3 N6 S Y2
Title of publication	A binuclear guanidinate yttrium carbyne complex: unique reactivity toward unsaturated C-N, C-O and C-S bonds.
Authors of publication	Jiang, Wen; Kong, Feng; Del Rosal, Iker; Li, Meng; Wang, Kai; Maron, Laurent; Zhang, Lixin
Journal of publication	Chemical science
Year of publication	2023
Journal volume	14
Journal issue	34
Pages of publication	9154 - 9160
a	10.482 ± 0.0006 Å
b	36.766 ± 0.002 Å
c	11.9467 ± 0.0007 Å
α	90°
β	112.166 ± 0.002°
γ	90°
Cell volume	4263.8 ± 0.4 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	172.97 K
Number of distinct elements	7
Space group number	11
Hermann-Mauguin space group symbol	P 1 21/m 1
Hall space group symbol	-P 2yb
Residual factor for all reflections	0.0621
Residual factor for significantly intense reflections	0.0528
Weighted residual factors for significantly intense reflections	0.1444
Weighted residual factors for all reflections included in the refinement	0.1515
Goodness-of-fit parameter for all reflections included in the refinement	1.066
Diffraction radiation wavelength	1.34139 Å
Diffraction radiation type	GaKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
286069 (current)	2023-09-05	cif/ Updating files of 1569608, 1569609, 1569610, 1569611, 1569612, 1569613, 1569614, 1569615 Original log message: Adding full bibliography for 1569608--1569615.cif.	1569614.cif
285438	2023-08-04	cif/ Adding structures of 1569608, 1569609, 1569610, 1569611, 1569612, 1569613, 1569614, 1569615 via cif-deposit CGI script.	1569614.cif