Crystallography Open Database

Information card for entry 7020964

7020963 << 7020964 >> 7020965

Preview

Coordinates	7020964.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C34 H31 B F10 N P
Calculated formula	C34 H31 B F10 N P
SMILES	C1C(c2ccccc2)P(C(C)(C)C)(C(C)(C)C)=[N](c2ccccc2)[B]1(c1c(c(c(c(c1F)F)F)F)F)c1c(c(c(c(c1F)F)F)F)F
Title of publication	Hydrophosphination of vinyl-boranes with phosphinoamines
Authors of publication	Jiang, Chunfang; Stephan, Douglas W.
Journal of publication	Dalton Transactions
Year of publication	2013
Journal volume	42
Journal issue	10
Pages of publication	3318
a	11.0192 ± 0.001 Å
b	17.8227 ± 0.0015 Å
c	16.3592 ± 0.0015 Å
α	90°
β	106.482 ± 0.003°
γ	90°
Cell volume	3080.8 ± 0.5 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 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	0.0455
Residual factor for significantly intense reflections	0.0346
Weighted residual factors for significantly intense reflections	0.083
Weighted residual factors for all reflections included in the refinement	0.0891
Goodness-of-fit parameter for all reflections included in the refinement	1.023
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7020964.html