Crystallography Open Database

Information card for entry 4329807

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Coordinates	4329807.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C15 H9 Cl2 Cu2 N9 Se3
Calculated formula	C15 H9 Cl2 Cu2 N9 Se3
Title of publication	Selenadiazolopyridine: A Synthon for Supramolecular Assembly and Complexes with Metallophilic Interactions
Authors of publication	Goutam Mukherjee; Puspendra Singh; Chandrasekhar Ganguri; Sagar Sharma; Harkesh B. Singh; Nidhi Goel; Udai P. Singh; Ray J. Butcher
Journal of publication	Inorganic Chemistry
Year of publication	2012
Journal volume	51
Pages of publication	8128 - 8140
a	17.964 ± 0.002 Å
b	9.3797 ± 0.0009 Å
c	12.7632 ± 0.0017 Å
α	90°
β	112.678 ± 0.007°
γ	90°
Cell volume	1984.3 ± 0.4 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 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	0.09
Residual factor for significantly intense reflections	0.0614
Weighted residual factors for significantly intense reflections	0.127
Weighted residual factors for all reflections included in the refinement	0.1365
Goodness-of-fit parameter for all reflections included in the refinement	1.139
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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