Crystallography Open Database

Information card for entry 7236349

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Coordinates	7236349.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C114 H30 N4 Zn
Calculated formula	C114 H30 N4 Zn
Title of publication	Fullerene-linked tetrabenzoporphyrins for solution-processed organic photovoltaics: flexible vs. rigid linkers
Authors of publication	Tamura, Yuto; Kuzuhara, Daiki; Suzuki, Mitsuharu; Hayashi, Hironobu; Aratani, Naoki; Yamada, Hiroko
Journal of publication	Journal of Materials Chemistry A
Year of publication	2016
Journal volume	4
Journal issue	40
Pages of publication	15333
a	10.04 ± 0.006 Å
b	12.65 ± 0.008 Å
c	33.76 ± 0.02 Å
α	86.692 ± 0.01°
β	88.631 ± 0.008°
γ	79.903 ± 0.009°
Cell volume	4214 ± 4 Å³
Cell temperature	90 ± 2 K
Ambient diffraction temperature	90 ± 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	0.3872
Residual factor for significantly intense reflections	0.199
Weighted residual factors for significantly intense reflections	0.341
Weighted residual factors for all reflections included in the refinement	0.4152
Goodness-of-fit parameter for all reflections included in the refinement	0.885
Diffraction radiation wavelength	0.78203 Å
Diffraction radiation type	synchrotron
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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