Crystallography Open Database

Information card for entry 4118928

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Coordinates	4118928.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C118 H160 N2 O P4 Pt2
Calculated formula	C114 H152 N2 P4 Pt2
Title of publication	Phenylene Vinylene Platinum(II) Acetylides with Prodigious Two-Photon Absorption
Authors of publication	Galyna G. Dubinina; Randi S. Price; Khalil A. Abboud; Geoffrey Wicks; Pawel Wnuk; Yuriy Stepanenko; Mikhail Drobizhev; Aleksander Rebane; Kirk S. Schanze
Journal of publication	Journal of the American Chemical Society
Year of publication	2012
Journal volume	134
Pages of publication	19346 - 19349
a	48.04 ± 0.003 Å
b	9.2092 ± 0.0006 Å
c	31.412 ± 0.002 Å
α	90°
β	125.79 ± 0.001°
γ	90°
Cell volume	11272.8 ± 1.3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0416
Residual factor for significantly intense reflections	0.0324
Weighted residual factors for significantly intense reflections	0.0786
Weighted residual factors for all reflections included in the refinement	0.0823
Goodness-of-fit parameter for all reflections included in the refinement	1.063
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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