Crystallography Open Database

Information card for entry 7121557

Preview

Coordinates	7121557.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C39 H123 N18 O28 Rh5 S15 Zn4
Calculated formula	C38.9994 H98.9982 N17.9997 O27.9994 Rh4.9999 S14.9997 Zn4
Title of publication	Two-step chiral transfer from d-penicillamine to metallosupramolecular ionic crystals.
Authors of publication	Yasukawa, Yuhei; Yoshinari, Nobuto; Konno, Takumi
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2018
Journal volume	54
Journal issue	39
Pages of publication	5003 - 5006
a	20.209 ± 0.0003 Å
b	20.209 ± 0.0003 Å
c	21.1201 ± 0.0004 Å
α	90°
β	90°
γ	120°
Cell volume	7469.9 ± 0.2 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	7
Space group number	146
Hermann-Mauguin space group symbol	R 3 :H
Hall space group symbol	R 3
Residual factor for all reflections	0.1161
Residual factor for significantly intense reflections	0.0908
Weighted residual factors for significantly intense reflections	0.2667
Weighted residual factors for all reflections included in the refinement	0.2922
Goodness-of-fit parameter for all reflections included in the refinement	1.09
Diffraction radiation wavelength	0.6 Å
Diffraction radiation type	synchrotron
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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