Crystallography Open Database

Information card for entry 4311038

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Coordinates	4311038.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C44 H98 Cl2 Cr2 Cu4 N34 O14
Calculated formula	C44 H80 Cl2 Cr2 Cu4 N34 O14
Title of publication	Cyano-Bridged 2D CuII-CrIII Coordination Polymers: Structural Evidence for Formation of a Polymeric Macrocyclic Metallic Compound
Authors of publication	Hui-Zhong Kou; Yun-Bo Jiang; Bei Chuan Zhou; Ru-Ji Wang
Journal of publication	Inorganic Chemistry
Year of publication	2004
Journal volume	43
Pages of publication	3271 - 3276
a	20.446 ± 0.004 Å
b	20.476 ± 0.003 Å
c	19.852 ± 0.003 Å
α	90°
β	113.357 ± 0.009°
γ	90°
Cell volume	7630 ± 2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.0966
Residual factor for significantly intense reflections	0.0532
Weighted residual factors for significantly intense reflections	0.109
Weighted residual factors for all reflections included in the refinement	0.1259
Goodness-of-fit parameter for all reflections included in the refinement	1.069
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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