Crystallography Open Database

Information card for entry 7100176

Preview

Coordinates	7100176.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14 H8 N2 O9 Ru3
Calculated formula	C14 H8 N2 O9 Ru3
SMILES	C12N(C=CN1C)C1[RuH]3(C#[O])(C#[O])(C#[O])[RuH]=2(C#[O])(C#[O])(C#[O])[Ru]13(C#[O])(C#[O])C#[O]
Title of publication	Easy activation of two CH bonds of an N-heterocyclic carbene N-methyl group
Authors of publication	Javier A. Cabeza; I.del Rio; M. Gabriela Sanchez-Vega; Daniel Miguel
Journal of publication	Chemical Communications
Year of publication	2005
a	10.455 ± 0.008 Å
b	9.915 ± 0.008 Å
c	18.843 ± 0.015 Å
α	90°
β	95.799 ± 0.016°
γ	90°
Cell volume	1943 ± 3 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

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