Crystallography Open Database

Information card for entry 7711809

Preview

Coordinates	7711809.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H55 Mo O3 P Si2
Calculated formula	C36 H55 Mo O3 P Si2
SMILES	[Mo]12345([P](C)(C)C)(O[Si](OC=1[Si](C)(C)C)(c1c(cc(cc1C)C)C)c1c(cc(cc1C)C)C)(C#[O])[c]1([c]2([c]3([c]4([c]51C)C)C)C)C
Title of publication	Synthesis and structure of a pyridine-stabilized silanone molybdenum complex and its reactions with PMe3 and acetone
Authors of publication	Muraoka, Takako; Suzuki, Yuzuki; Tsuchimoto, Masato; Trigagema, Gama; Ueno, Keiji; Koyama, Shinji
Journal of publication	Dalton Transactions
Year of publication	2022
a	28.053 ± 0.003 Å
b	28.053 ± 0.003 Å
c	9.461 ± 0.0013 Å
α	90°
β	90°
γ	90°
Cell volume	7445.5 ± 1.5 Å³
Cell temperature	130 ± 2 K
Ambient diffraction temperature	130 ± 2 K
Number of distinct elements	6
Space group number	114
Hermann-Mauguin space group symbol	P -4 21 c
Hall space group symbol	P -4 2n
Residual factor for all reflections	0.0442
Residual factor for significantly intense reflections	0.0363
Weighted residual factors for significantly intense reflections	0.0855
Weighted residual factors for all reflections included in the refinement	0.0887
Goodness-of-fit parameter for all reflections included in the refinement	1.046
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
279408 (current)	2022-11-19	cif/ Adding structures of 7711806, 7711807, 7711808, 7711809 via cif-deposit CGI script.	7711809.cif