Crystallography Open Database

Information card for entry 4308065

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Structure parameters

Formula	C30 H28 B F15 N P
Calculated formula	C30 H28 B F15 N P
SMILES	P(=[NH][B](c1c(F)c(F)c(F)c(F)c1F)(c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F)(C(C)(C)C)(C(C)(C)C)C(C)(C)C
Title of publication	Boron and Aluminum Complexes of Sterically Demanding Phosphinimines and Phosphinimides
Authors of publication	Silke Courtenay; Denise Walsh; Sarah Hawkeswood; Pingrong Wei; Anjan Kumar Das; Douglas W. Stephan
Journal of publication	Inorganic Chemistry
Year of publication	2007
Journal volume	46
Pages of publication	3623 - 3631
a	11.384 ± 0.018 Å
b	12.84 ± 0.02 Å
c	21.46 ± 0.04 Å
α	90°
β	91.77 ± 0.04°
γ	90°
Cell volume	3135 ± 9 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
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	0.0671
Residual factor for significantly intense reflections	0.0499
Weighted residual factors for significantly intense reflections	0.1234
Weighted residual factors for all reflections included in the refinement	0.1344
Goodness-of-fit parameter for all reflections included in the refinement	0.979
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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