Crystallography Open Database

Information card for entry 7225659

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Structure parameters

Formula	C32 H24 N2
Calculated formula	C32 H24 N2
SMILES	c1cc(c2ccccc2)c2c(c(C)cc(c2)c2cc(C)c3c(c2)c(c2ccccc2)ccn3)n1
Title of publication	A Concise Synthesis of Quinolinium, and Biquinolinium Salts and Biquinolines from Benzylic Azides and Alkenes Promoted by Copper(II) Species
Authors of publication	Chen, Wei-Chen; Parthasarathy, Gandeepan; Tsai, Chia-Hung; Luo, Ching-Zong; Rajamalli, Pachaiyappan; Cheng, Chien Hong
Journal of publication	RSC Adv.
Year of publication	2016
a	7.917 ± 0.006 Å
b	22.675 ± 0.014 Å
c	25.49 ± 0.02 Å
α	90°
β	90°
γ	90°
Cell volume	4576 ± 6 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	3
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.3434
Residual factor for significantly intense reflections	0.0946
Weighted residual factors for significantly intense reflections	0.1475
Weighted residual factors for all reflections included in the refinement	0.2222
Goodness-of-fit parameter for all reflections included in the refinement	0.915
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
301865 (current)	2025-08-22	Add cross-references to PubChem compounds in COD range 7/22/ Each referenced PubChem compound corresponds to the full crystal structure.	7225659.cif
183903	2016-06-24	cif/ Adding structures of 7225658, 7225659, 7225660 via cif-deposit CGI script.	7225659.cif