Crystallography Open Database

Information card for entry 2000001

2000000 << 2000001 >> 2000002

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Coordinates	2000001.cif

Structure parameters

Formula	C4 H6 Cl4 N2 Zr
Calculated formula	C4 H6 Cl4 N2 Zr
Title of publication	ZrCl~4~ behavior in acetonitrile. Crystal structure of ZrCl~4~, 2CH~3~CN
Authors of publication	Guery, J.; Leblanc, M.; Jacoboni, C.
Journal of publication	European Journal of Solid State and Inorganic Chemistry
Year of publication	1989
Journal volume	26
Journal issue	3
Pages of publication	289 - 297
a	6.1203 ± 0.0002 Å
b	13.7779 ± 0.0008 Å
c	13.4435 ± 0.0007 Å
α	90°
β	99.229 ± 0.003°
γ	90°
Cell volume	1118.95 Å³
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for significantly intense reflections	0.032
Weighted residual factors for significantly intense reflections	0.032
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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