Information card for entry 7100554

Structure parameters

• Formula: C8 H6 N2 O5 W
• Calculated formula: C8 H6 N2 O5 W
• SMILES: [W](=C1NCCN1)(C#[O])(C#[O])(C#[O])(C#[O])C#[O]
• Title of publication: Template synthesis of tungsten complexes with saturated N-heterocyclic carbene ligands
• Authors of publication: Ekkehardt Hahn; Volker Langenhahn; Tania Pape
• Journal of publication: Chemical Communications
• Year of publication: 2005
• a: 6.667 ± 0.001 Å
• b: 8.5579 ± 0.0012 Å
• c: 10.1724 ± 0.0015 Å
• α: 94.486 ± 0.003°
• β: 106.524 ± 0.003°
• γ: 100.679 ± 0.003°
• Cell volume: 541.48 ± 0.14 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No