Crystallography Open Database





Information card for 2013201

2013200 << 2013201 >> 2013202

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Coordinates

2013201.cif

Structure factors

2013201.hkl

Structure parameters

Formula - C9 H15 N5 O3 -
Calculated formula - C9 H15 N5 O3 -
Title of publication Hydrogen bonding in nitroaniline analogues: a hydrogen-bonded chain of rings in 2-amino-4-butylamino-6-methoxy-5-nitropyrimidine
Authors of publication Glidewell, Christopher; Low, John N.; Melguizo, Manuel; Quesada, Antonio
Journal of publication Acta Crystallographica, Section C
Year of publication 2003
Journal volume 59
Pages of publication o19 - o21
a 20.5825 ± 0.0013 Å
b 8.8102 ± 0.0004 Å
c 13.0289 ± 0.0011 Å
α 90°
β 109.81 ± 0.003°
γ 90°
Cell volume 2222.8 ± 0.3 Å3
Cell temperature 120 ± 1 K
Ambient diffraction temperature 120 ± 1 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 Yes
Has Fobs Yes

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