Crystallography Open Database

Information card for entry 4517284

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Coordinates	4517284.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C200 H78 N4 O8
Calculated formula	C200 H78 N4 O8
Title of publication	One-dimensional Fullerene/Porphyrin Cocrystals: Near-infrared Light Sensing Through Component Interactions.
Authors of publication	Wakahara, Takatsugu; Nagaoka, Kahori; Nakagawa, Akari; Hirata, Chika; Matsushita, Yoshitaka; Miyazawa, Kun'ichi; Ito, Osamu; Wada, Yoshiki; Takagi, Makito; Ishimoto, Takayoshi; Tachikawa, Masanori; Tsukagoshi, Kazuhito
Journal of publication	ACS applied materials & interfaces
Year of publication	2019
a	13.9823 ± 0.0004 Å
b	22.3768 ± 0.0006 Å
c	19.3193 ± 0.0005 Å
α	90°
β	103.105 ± 0.001°
γ	90°
Cell volume	5887.2 ± 0.3 Å³
Cell temperature	113 ± 2 K
Ambient diffraction temperature	113 ± 2 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	0.2275
Residual factor for significantly intense reflections	0.1979
Weighted residual factors for significantly intense reflections	0.5325
Weighted residual factors for all reflections included in the refinement	0.5692
Goodness-of-fit parameter for all reflections included in the refinement	2.713
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
246323 (current)	2020-01-01	cif/ Adding structures of 4517284 via cif-deposit CGI script.	4517284.cif