Crystallography Open Database

Information card for entry 7707445

Preview

Coordinates	7707445.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C97 H53 Cl N8 O38 Rh2 Zr6
Calculated formula	C97 H53 Cl N8 O38 Rh2 Zr6
Title of publication	Immobilization of Rh(I) precursor in a porphyrin metal-organic framework - turning on the catalytic activity.
Authors of publication	Szczepkowska, Anna M.; Janeta, Mateusz; Siczek, Miłosz; Tylus, Włodzimierz; Trzeciak, Anna M.; Bury, Wojciech
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2021
Journal volume	50
Journal issue	26
Pages of publication	9051 - 9058
a	42.262 ± 0.008 Å
b	42.262 ± 0.008 Å
c	16.951 ± 0.002 Å
α	90°
β	90°
γ	120°
Cell volume	26220 ± 8 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	7
Space group number	191
Hermann-Mauguin space group symbol	P 6/m m m
Hall space group symbol	-P 6 2
Residual factor for all reflections	0.1356
Residual factor for significantly intense reflections	0.0964
Weighted residual factors for significantly intense reflections	0.2784
Weighted residual factors for all reflections included in the refinement	0.3173
Goodness-of-fit parameter for all reflections included in the refinement	1.165
Diffraction radiation probe	x-ray
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
268762 (current)	2021-09-06	cif/ Updating files of 7707445, 7707446, 7707447 Original log message: Adding full bibliography for 7707445--7707447.cif.	7707445.cif
265353	2021-05-20	cif/ Adding structures of 7707445, 7707446, 7707447 via cif-deposit CGI script.	7707445.cif