Crystallography Open Database

Information card for entry 1570290

Preview

Coordinates	1570290.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C74 H58 Br F40 N Sb4
Calculated formula	C74 H58 Br F40 N Sb4
SMILES	[Sb](C#Cc1c2C3c4c(cccc4C(c2ccc1)C1c2c(C3c3c(cccc13)C#C[Sb](C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)F)c(ccc2)C#C[Sb](C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)F)C#C[Sb](C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)F)(C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)F.[Br-].[N+](CCCC)(CCCC)(CCCC)CCCC.c1ccccc1
Title of publication	Poly-pnictogen bonding: trapping halide ions by a tetradentate antimony(iii) Lewis acid.
Authors of publication	Beckmann, J. Louis; Krieft, Jonas; Vishnevskiy, Yury V.; Neumann, Beate; Stammler, Hans-Georg; Mitzel, Norbert W.
Journal of publication	Chemical science
Year of publication	2023
Journal volume	14
Journal issue	46
Pages of publication	13551 - 13559
a	15.9954 ± 0.0005 Å
b	19.9387 ± 0.0005 Å
c	26.1599 ± 0.0006 Å
α	90°
β	103.584 ± 0.002°
γ	90°
Cell volume	8109.7 ± 0.4 Å³
Cell temperature	100 ± 0.1 K
Ambient diffraction temperature	100 ± 0.1 K
Number of distinct elements	6
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	0.0793
Residual factor for significantly intense reflections	0.0539
Weighted residual factors for significantly intense reflections	0.1284
Weighted residual factors for all reflections included in the refinement	0.1455
Goodness-of-fit parameter for all reflections included in the refinement	1.059
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
288743 (current)	2024-01-06	cif/ Updating files of 1570287, 1570288, 1570289, 1570290 Original log message: Adding full bibliography for 1570287--1570290.cif.	1570290.cif
287524	2023-11-11	cif/ Adding structures of 1570287, 1570288, 1570289, 1570290 via cif-deposit CGI script.	1570290.cif