Crystallography Open Database

Information card for entry 7227289

Preview

Coordinates	7227289.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H23 N
Calculated formula	C32 H23 N
SMILES	c1(c2ccccc2cc2c1cccc2)c1ccc(N(c2ccccc2)c2ccccc2)cc1
Title of publication	Crystalline triphenylamine substituted arenes: solid state packing and luminescence properties
Authors of publication	Mallia, Ajith R.; Ramakrishnan, Remya; Niyas, M. A.; Hariharan, Mahesh
Journal of publication	CrystEngComm
Year of publication	2017
Journal volume	19
Journal issue	5
Pages of publication	817
a	14.0037 ± 0.0003 Å
b	18.865 ± 0.0004 Å
c	9.2913 ± 0.0002 Å
α	90°
β	109.592 ± 0.001°
γ	90°
Cell volume	2312.46 ± 0.09 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	3
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0525
Residual factor for significantly intense reflections	0.0411
Weighted residual factors for significantly intense reflections	0.1044
Weighted residual factors for all reflections included in the refinement	0.1176
Goodness-of-fit parameter for all reflections included in the refinement	1.05
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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