Crystallography Open Database

Information card for entry 4112442

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Coordinates	4112442.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C21 H20 N2 Pt Si
Calculated formula	C21 H20 N2 Pt Si
Title of publication	Light-Emitting Tridentate Cyclometalated Platinum(II) Complexes Containing σ-Alkynyl Auxiliaries: Tuning of Photo- and Electrophosphorescence
Authors of publication	Wei Lu; Bao-Xiu Mi; Michael C. W. Chan; Zheng Hui; Chi-Ming Che; Nianyong Zhu; Shuit-Tong Lee
Journal of publication	Journal of the American Chemical Society
Year of publication	2004
Journal volume	126
Pages of publication	4958 - 4971
a	11.903 ± 0.002 Å
b	12.626 ± 0.002 Å
c	13.205 ± 0.002 Å
α	90°
β	101.08 ± 0.02°
γ	90°
Cell volume	1947.6 ± 0.6 Å³
Cell temperature	301.2 K
Ambient diffraction temperature	301.2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for significantly intense reflections	0.0449
Weighted residual factors for significantly intense reflections	0.0622
Goodness-of-fit parameter for significantly intense reflections	1.466
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKalpha
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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