Crystallography Open Database

Information card for entry 7052788

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Coordinates	7052788.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C85 H76 Cl2 I N4 P2 Rh
Calculated formula	C85 H76 Cl2 I N4 P2 Rh
Title of publication	Ruthenium(ii) and rhodium(iii) porphyrin phosphine complexes: influence of substitution pattern on structure and electronic properties
Authors of publication	Bond, Andrew D.; Sanders, Jeremy K. M.; Stulz, Eugen
Journal of publication	New Journal of Chemistry
Year of publication	2011
Journal volume	35
Journal issue	11
Pages of publication	2691
a	26.5305 ± 0.0005 Å
b	12.1202 ± 0.0003 Å
c	22.0169 ± 0.0004 Å
α	90°
β	94.01 ± 0.002°
γ	90°
Cell volume	7062.3 ± 0.3 Å³
Cell temperature	180 ± 2 K
Ambient diffraction temperature	180 ± 2 K
Number of distinct elements	7
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0509
Residual factor for significantly intense reflections	0.0342
Weighted residual factors for significantly intense reflections	0.0825
Weighted residual factors for all reflections included in the refinement	0.0979
Goodness-of-fit parameter for all reflections included in the refinement	1.137
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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