Crystallography Open Database





Information card for 2012438

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Coordinates

2012438.cif

Structure factors

2012438.hkl

Structure parameters

Formula - C12 H15 N7 O7 -
Calculated formula - C12 H15 N7 O7 -
Title of publication Hexamethylenetetraminium 2,4,6-trinitrophenolate
Authors of publication Usman, Anwar; Chantrapromma, Suchada; Fun, Hoong-Kun; Poh, Bo-Long; Karalai, Chatchanok
Journal of publication Acta Crystallographica, Section C
Year of publication 2002
Journal volume 58
Pages of publication o46 - o47
a 12.4995 ± 0.0002 Å
b 6.6344 ± 0.0001 Å
c 18.6203 ± 0.0002 Å
α 90°
β 107.022 ± 0.001°
γ 90°
Cell volume 1476.48 ± 0.04 Å3
Cell temperature 183 ± 2 K
Ambient diffraction temperature 183 ± 2 K
Number of distinct elements 4
Hermann-Mauguin symmetry space group P 1 21/c 1
Hall symmetry space group -P 2ybc
Has coordinates Yes
Has disorder No
Has Fobs Yes

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