Crystallography Open Database
COD Home
Home
What's new?
Accessing COD Data
Browse
Search
Add Your Data
Deposit your data
Manage depositions
Manage/release prepublications
Documentation
COD Wiki
Obtaining COD
Citing COD
COD Mirrors
Advices to donators
CIF Information Card
Information card for 2013201
2013200
<<
2013201
>>
2013202
Preview
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 Å
3
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 F
obs
Yes
Top of the page