Crystallography Open Database

Information card for entry 7717586

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Coordinates	7717586.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H32 B10 Si
Calculated formula	C20 H32 B10 Si
Title of publication	Modulating radiative efficiency in <i>ortho</i>-carboranyl luminophores through electron-donating substituents: insights from intramolecular-charge-transfer-based emissions.
Authors of publication	Kim, Soyeon; You, Dong Kyun; Kim, Namkyun; Shin, Ilsup; Kim, Dongwook; Lee, Kang Mun
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2024
a	9.3569 ± 0.0006 Å
b	10.8812 ± 0.0006 Å
c	12.1208 ± 0.0007 Å
α	98.2648 ± 0.0019°
β	94.752 ± 0.002°
γ	92.699 ± 0.002°
Cell volume	1214.88 ± 0.12 Å³
Cell temperature	203 ± 2 K
Ambient diffraction temperature	203 ± 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	0.0568
Residual factor for significantly intense reflections	0.045
Weighted residual factors for significantly intense reflections	0.114
Weighted residual factors for all reflections included in the refinement	0.1229
Goodness-of-fit parameter for all reflections included in the refinement	1.021
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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