Crystallography Open Database

Information card for entry 4135609

Preview

Coordinates	4135609.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C51 H82 Bi F9 Li2 N2 O11 S3
Calculated formula	C51 H82 Bi F9 Li2 N2 O11 S3
Title of publication	Donor-Stabilized Antimony(I) and Bismuth(I) Ions: Heavier Valence Isoelectronic Analogues of Carbones.
Authors of publication	Siddiqui, Mujahuddin M.; Sarkar, Samir Kumar; Nazish, Mohd; Morganti, Massimiliano; Köhler, Christian; Cai, Jiali; Zhao, Lili; Herbst-Irmer, Regine; Stalke, Dietmar; Frenking, Gernot; Roesky, Herbert W.
Journal of publication	Journal of the American Chemical Society
Year of publication	2021
Journal volume	143
Journal issue	3
Pages of publication	1301 - 1306
a	24.689 ± 0.002 Å
b	9.342 ± 0.002 Å
c	27.653 ± 0.003 Å
α	90°
β	98.07 ± 0.02°
γ	90°
Cell volume	6314.9 ± 1.6 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	8
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	0.037
Residual factor for significantly intense reflections	0.0253
Weighted residual factors for significantly intense reflections	0.048
Weighted residual factors for all reflections included in the refinement	0.0512
Goodness-of-fit parameter for all reflections included in the refinement	1.015
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
261474 (current)	2021-02-04	cif/ Adding structures of 4135609 via cif-deposit CGI script.	4135609.cif