Crystallography Open Database

Information card for entry 7100849

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Coordinates	7100849.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H8 Cu N5
Calculated formula	C12 H8 Cu N5
Title of publication	Molecular Chairs, Zippers, Zigzag and Helical Chains: Chemical Enumeration of Supramolecular Isomerism Based on a Predesigned Metal-Organic Building Block
Authors of publication	Jie-Peng Zhang; Yan-Yong Lin; Xiao-Chun Huang; Xiao-Ming Chen
Journal of publication	Chemical Communications
Year of publication	2005
a	11.532 ± 0.001 Å
b	11.532 ± 0.001 Å
c	18.29 ± 0.001 Å
α	90°
β	90°
γ	90°
Cell volume	2432.3 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	96
Hermann-Mauguin space group symbol	P 43 21 2
Hall space group symbol	P 4nw 2abw
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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