Crystallography Open Database

Information card for entry 7127748

Preview

Coordinates	7127748.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	CFmoc
Formula	C168 H124 Cu4 N12 O28
Calculated formula	C168 H124 Cu4 N12 O28
Title of publication	A covalent deprotection strategy for assembling supramolecular coordination polymers from metal-organic cages.
Authors of publication	Schneider, Matthew L.; Linder-Patton, Oliver M; Bloch, Witold M.
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2020
Journal volume	56
Journal issue	85
Pages of publication	12969 - 12972
a	16.005 ± 0.003 Å
b	17.777 ± 0.004 Å
c	20.441 ± 0.004 Å
α	104.91 ± 0.03°
β	109.45 ± 0.03°
γ	104.86 ± 0.03°
Cell volume	4912 ± 3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0735
Residual factor for significantly intense reflections	0.0655
Weighted residual factors for significantly intense reflections	0.209
Weighted residual factors for all reflections included in the refinement	0.217
Goodness-of-fit parameter for all reflections included in the refinement	1.072
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	Synchrotron
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
260466 (current)	2021-01-04	cif/ Adding structures of 7127747, 7127748 via cif-deposit CGI script.	7127748.cif