Crystallography Open Database

Information card for entry 7234863

Preview

Coordinates	7234863.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H29 N O2
Calculated formula	C24 H29 N O2
SMILES	O=C1c2c(cccc2)C([O-])=C1c1cc([n+](c(c1)C)CCCCCCCC)C
Title of publication	The effect of N-alkyl chain length on the photophysical properties of indene-1,3-dionemethylene-1,4-dihydropyridine derivatives
Authors of publication	Yanze Liu; Yunxiang Lei; Miaochang Liu; Fei Li; Hongping Xiao; Jiuxi Chen; Xiaobo Huang; Wenxia Gao; Huayue Wu; Yixiang Cheng
Journal of publication	Journal of Materials Chemistry C
Year of publication	2016
Journal volume	4
Pages of publication	5970 - 5980
a	7.9388 ± 0.0015 Å
b	8.0318 ± 0.0015 Å
c	17.599 ± 0.003 Å
α	82.094 ± 0.003°
β	88.252 ± 0.003°
γ	65.864 ± 0.003°
Cell volume	1013.9 ± 0.3 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0778
Residual factor for significantly intense reflections	0.0719
Weighted residual factors for significantly intense reflections	0.2329
Weighted residual factors for all reflections included in the refinement	0.245
Goodness-of-fit parameter for all reflections included in the refinement	1.096
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
220538 (current)	2019-10-30	cif/ Adding structures of 7234862, 7234863, 7234864, 7234865 via cif-deposit CGI script.	7234863.cif