Crystallography Open Database

Information card for entry 4340492

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Coordinates	4340492.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C34 H30 N8 O8 P2 Ru S
Calculated formula	C34 H30 N8 O7.95 P2 Ru S
Title of publication	Bis-Heteroleptic Ruthenium(II) Complex of a Triazole Ligand as a Selective Probe for Phosphates.
Authors of publication	Chowdhury, Bijit; Khatua, Snehadrinarayan; Dutta, Ranjan; Chakraborty, Sourav; Ghosh, Pradyut
Journal of publication	Inorganic chemistry
Year of publication	2014
Journal volume	53
Journal issue	15
Pages of publication	8061
a	12.9335 ± 0.0004 Å
b	13.0948 ± 0.0004 Å
c	13.4186 ± 0.0004 Å
α	102.718 ± 0.001°
β	106.604 ± 0.001°
γ	95.232 ± 0.001°
Cell volume	2095.34 ± 0.11 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0517
Residual factor for significantly intense reflections	0.0478
Weighted residual factors for significantly intense reflections	0.134
Weighted residual factors for all reflections included in the refinement	0.1367
Goodness-of-fit parameter for all reflections included in the refinement	1.087
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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