Crystallography Open Database

Information card for entry 2007295

2007294 << 2007295 >> 2007296

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Coordinates	2007295.cif
Original IUCr paper	HTML

Structure parameters

Formula	C21 H17 Cl2 N3
Calculated formula	C21 H17 Cl2 N3
SMILES	Clc1cccc(c1NCc1nc2c(n1Cc1ccccc1)cccc2)Cl
Title of publication	1-Benzyl-2-(2,6-dichloroanilinomethyl)-1<i>H</i>-benzimidazole
Authors of publication	Kendi, Engin; Özbey, Süheyla; Tunçbilek, Meral; Göker, Hakan
Journal of publication	Acta Crystallographica Section C
Year of publication	1998
Journal volume	54
Journal issue	6
Pages of publication	854 - 856
a	11.2662 ± 0.0013 Å
b	9.8162 ± 0.001 Å
c	17.2773 ± 0.0018 Å
α	90°
β	102.47 ± 0.01°
γ	90°
Cell volume	1865.6 ± 0.4 Å³
Cell temperature	295 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for significantly intense reflections	0.0336
Weighted residual factors for significantly intense reflections	0.039
Goodness-of-fit parameter for significantly intense reflections	0.71
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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