Crystallography Open Database

Information card for entry 1568209

Preview

Coordinates	1568209.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H30 F76 Fe Hg10 Mo N10 O4 S2 Sb10
Calculated formula	C30 H30 F76 Fe Hg10 Mo N10 O4 S2 Sb10
Title of publication	A decacationic ferrocene-based metallostar.
Authors of publication	Rupf, Susanne Margot; Moshtaha, Amina Leoni; Malischewski, Moritz
Journal of publication	Chemical science
Year of publication	2023
Journal volume	14
Journal issue	5
Pages of publication	1132 - 1137
a	11.5091 ± 0.0007 Å
b	16.0047 ± 0.0012 Å
c	16.969 ± 0.0011 Å
α	78.893 ± 0.003°
β	83.202 ± 0.002°
γ	80.19 ± 0.003°
Cell volume	3010.4 ± 0.4 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	10
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0336
Residual factor for significantly intense reflections	0.03
Weighted residual factors for significantly intense reflections	0.068
Weighted residual factors for all reflections included in the refinement	0.0697
Goodness-of-fit parameter for all reflections included in the refinement	0.949
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
281353 (current)	2023-03-04	cif/ Updating files of 1568209, 1568210, 1568211 Original log message: Adding full bibliography for 1568209--1568211.cif.	1568209.cif
280057	2022-12-29	cif/ Adding structures of 1568209, 1568210, 1568211 via cif-deposit CGI script.	1568209.cif