Crystallography Open Database

Information card for entry 2236801

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Structure parameters

Chemical name	2-(4-Chlorophenyl)-6-methyl-4-(3-methylphenyl)quinoline
Formula	C23 H18 Cl N
Calculated formula	C23 H18 Cl N
SMILES	Clc1ccc(cc1)c1nc2c(c(c1)c1cccc(c1)C)cc(cc2)C
Title of publication	2-(4-Chlorophenyl)-6-methyl-4-(3-methylphenyl)quinoline
Authors of publication	Prabhuswamy, M.; Swaroop, T. R.; Madan Kumar, S.; Rangappa, K. S.; Lokanath, N. K.
Journal of publication	Acta Crystallographica Section E
Year of publication	2012
Journal volume	68
Journal issue	11
Pages of publication	o3250
a	7.982 ± 0.003 Å
b	17.921 ± 0.006 Å
c	12.478 ± 0.004 Å
α	90°
β	92.581 ± 0.006°
γ	90°
Cell volume	1783.1 ± 1.1 Å³
Cell temperature	293 K
Ambient diffraction temperature	293 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0766
Residual factor for significantly intense reflections	0.0569
Weighted residual factors for significantly intense reflections	0.1505
Weighted residual factors for all reflections included in the refinement	0.1684
Goodness-of-fit parameter for all reflections included in the refinement	1.042
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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