Crystallography Open Database





Information card for 2013845

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Coordinates

2013845.cif

Structure factors

2013845.hkl

Structure parameters

Formula - C14 H10 Cl2 N4 -
Calculated formula - C14 H10 Cl2 N4 -
Title of publication Hydrogen-bonding patterns in two structural isomers of 3,6-bis(2-chlorophenyl)-1,4-dihydro-1,2,4,5-tetrazine
Authors of publication Zachara, Janusz; Madura, Izabela; Włostowski, Marek
Journal of publication Acta Crystallographica, Section C
Year of publication 2004
Journal volume 60
Pages of publication o57 - o59
a 16.002 ± 0.0012 Å
b 9.4123 ± 0.0008 Å
c 10.5752 ± 0.0007 Å
α 90°
β 121.664 ± 0.005°
γ 90°
Cell volume 1355.69 ± 0.18 Å3
Cell temperature 293 ± 2 K
Ambient diffraction temperature 293 ± 2 K
Number of distinct elements 4
Hermann-Mauguin symmetry space group C 1 2/c 1
Hall symmetry space group -C 2yc
Has coordinates Yes
Has disorder No
Has Fobs Yes

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