Crystallography Open Database

Information card for entry 4505383

Preview

Structure parameters

Common name	acridine
Chemical name	acridine
Formula	C13 H9 N
Calculated formula	C13 H9 N
SMILES	n1c2ccccc2cc2ccccc12
Title of publication	Formation of New Polymorphs of Acridine Using Dicarboxylic Acids as Crystallization Templates in Solution
Authors of publication	Mei, Xuefeng; Wolf, Christian
Journal of publication	Crystal Growth & Design
Year of publication	2004
Journal volume	4
Journal issue	6
Pages of publication	1099
a	6.174 ± 0.002 Å
b	23.497 ± 0.008 Å
c	12.868 ± 0.004 Å
α	90°
β	96.483 ± 0.006°
γ	90°
Cell volume	1854.8 ± 1 Å³
Cell temperature	187 ± 2 K
Ambient diffraction temperature	187 ± 2 K
Number of distinct elements	3
Space group number	9
Hermann-Mauguin space group symbol	C 1 c 1
Hall space group symbol	C -2yc
Residual factor for all reflections	0.1272
Residual factor for significantly intense reflections	0.0403
Weighted residual factors for significantly intense reflections	0.0757
Weighted residual factors for all reflections included in the refinement	0.086
Goodness-of-fit parameter for all reflections included in the refinement	0.684
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4505383.html