Crystallography Open Database

Information card for entry 7012029

7012028 << 7012029 >> 7012030

Preview

Coordinates	7012029.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C62.5 H47.5 Cl6 Cu4 N18.5 O6
Calculated formula	C62.5 H47.5 Cl6 Cu4 N18.5 O6
Title of publication	Benzotriazole as a structural component in chelating and bridging heterocyclic ligands; ruthenium, palladium, copper and silver complexes
Authors of publication	Richardson, Chris; Steel, Peter J.
Journal of publication	Dalton Transactions
Year of publication	2003
Journal issue	5
Pages of publication	992
a	42.585 ± 0.019 Å
b	13.589 ± 0.006 Å
c	24.55 ± 0.011 Å
α	90°
β	109.214 ± 0.007°
γ	90°
Cell volume	13415 ± 10 Å³
Cell temperature	163 ± 2 K
Ambient diffraction temperature	163 ± 2 K
Number of distinct elements	6
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	0.0886
Residual factor for significantly intense reflections	0.0495
Weighted residual factors for significantly intense reflections	0.1165
Weighted residual factors for all reflections included in the refinement	0.1306
Goodness-of-fit parameter for all reflections included in the refinement	0.96
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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