Crystallography Open Database

Information card for entry 7711986

7711985 << 7711986 >> 7711987

Preview

Coordinates	7711986.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	CH2PBMes(CH2)
Formula	C32 H44 B P
Calculated formula	C32 H44 B P
Title of publication	Frustrated Lewis pair-ligated tetrelenes.
Authors of publication	Omaña, Alvaro A; Frenette, Brandon L.; Dornsiepen, Eike; Kobayashi, Ryo; Ferguson, Michael J.; Iwamoto, Takeaki; Rivard, Eric
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2023
Journal volume	52
Journal issue	3
Pages of publication	774 - 786
a	10.23 ± 0.002 Å
b	19.008 ± 0.004 Å
c	14.985 ± 0.004 Å
α	90°
β	102.935 ± 0.004°
γ	90°
Cell volume	2839.9 ± 1.1 Å³
Cell temperature	193.15 K
Ambient diffraction temperature	193.15 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0741
Residual factor for significantly intense reflections	0.0486
Weighted residual factors for significantly intense reflections	0.1226
Weighted residual factors for all reflections included in the refinement	0.1405
Goodness-of-fit parameter for all reflections included in the refinement	1.04
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
283347 (current)	2023-05-05	cif/ Updating files of 7711983, 7711984, 7711985, 7711986, 7711987, 7711988, 7711989 Original log message: Adding full bibliography for 7711983--7711989.cif.	7711986.cif
279958	2022-12-21	cif/ Adding structures of 7711983, 7711984, 7711985, 7711986, 7711987, 7711988, 7711989 via cif-deposit CGI script.	7711986.cif