Crystallography Open Database

Information card for entry 7712339

Preview

Coordinates	7712339.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H62 B N8 O2 Si3 Y
Calculated formula	C40 H62 B N8 O2 Si3 Y
SMILES	[Y]12345(N([Si](C)(C)C)[Si]([CH]5=[C]1(N4[SiH2]c1ccccc1)Cc1ccc(OC)cc1)(C)C)([O]1CCCC1)[n]1n(c(cc1C)C)[BH](n1[n]3c(cc1C)C)n1[n]2c(cc1C)C
Title of publication	Selective Si−C(sp3) Bond Cleavage of Silyl−Bridged Amido Alkyl Ligand in an Yttrium Complex
Authors of publication	Cai, Jiamin; Zhang, Jie; Zhou, Xigeng
Journal of publication	Dalton Transactions
Year of publication	2023
a	9.7543 ± 0.0003 Å
b	10.6068 ± 0.0003 Å
c	22.019 ± 0.0007 Å
α	98.825 ± 0.001°
β	92.423 ± 0.001°
γ	96.481 ± 0.001°
Cell volume	2232.65 ± 0.12 Å³
Cell temperature	173 K
Ambient diffraction temperature	173 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0579
Residual factor for significantly intense reflections	0.0499
Weighted residual factors for significantly intense reflections	0.1362
Weighted residual factors for all reflections included in the refinement	0.1429
Goodness-of-fit parameter for all reflections included in the refinement	1.08
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.34138 Å
Diffraction radiation type	GaKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
281054 (current)	2023-02-21	cif/ Adding structures of 7712336, 7712337, 7712338, 7712339, 7712340, 7712341, 7712342 via cif-deposit CGI script.	7712339.cif