Crystallography Open Database

Information card for entry 4135326

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Coordinates	4135326.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H30 N Rh
Calculated formula	C30 H30 N Rh
Title of publication	Merging Two Functions in a Single Rh Catalyst System: Bimodular Conjugate for Light-Induced Oxidative Coupling
Authors of publication	Kim, Jinwoo; Kim, Dongwook; Chang, Sukbok
Journal of publication	Journal of the American Chemical Society
Year of publication	2020
a	8.4358 ± 0.0003 Å
b	11.8215 ± 0.0005 Å
c	11.8878 ± 0.0005 Å
α	89.4274 ± 0.0014°
β	84.7711 ± 0.0013°
γ	88.91 ± 0.0013°
Cell volume	1180.31 ± 0.08 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0271
Residual factor for significantly intense reflections	0.0229
Weighted residual factors for significantly intense reflections	0.0494
Weighted residual factors for all reflections included in the refinement	0.0538
Goodness-of-fit parameter for all reflections included in the refinement	1.202
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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