Crystallography Open Database

Information card for entry 7124067

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Coordinates	7124067.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C52 H50 N4 Pd
Calculated formula	C52 H50 N4 Pd
Title of publication	Carbazole-Containing Porphyrinoid and its Oligomers
Authors of publication	Song, Jianxin; Wu, Tongjing; Kim, Taeyeon; Yin, Bangshao; Wang, Kaisheng; Xu, Ling; Zhou, Mingbo; Kim, Dongho
Journal of publication	Chemical Communications
Year of publication	2019
a	14.3716 ± 0.0002 Å
b	16.9373 ± 0.0002 Å
c	21.8677 ± 0.0002 Å
α	99.8281 ± 0.001°
β	106.821 ± 0.0013°
γ	100.542 ± 0.0012°
Cell volume	4865.71 ± 0.11 Å³
Cell temperature	99.99 ± 0.1 K
Ambient diffraction temperature	99.99 ± 0.1 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	0.0545
Residual factor for significantly intense reflections	0.0492
Weighted residual factors for significantly intense reflections	0.1336
Weighted residual factors for all reflections included in the refinement	0.1382
Goodness-of-fit parameter for all reflections included in the refinement	1.073
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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